USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 754 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl 163:sc= -0.0598 (180deg=-0.656) USER MOD Single : A 67 MET CE :methyl -128:sc= -6.33! (180deg=-10.8!) USER MOD Single : A 70 THR OG1 : rot -63:sc= -0.392 USER MOD Single : A 72 SER OG : rot 180:sc= 0.0213 USER MOD Single : A 74 ASN : amide:sc= -0.0927 K(o=-0.093,f=-1.4!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -62:sc= 0.996 USER MOD Single : A 84 THR OG1 : rot 140:sc= 1.26 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.012 X(o=-0.012,f=0) USER MOD Single : A 90 SER OG : rot 122:sc= 0.0038 USER MOD Single : A 93 ASN : amide:sc= -3.29 X(o=-3.3,f=-3.2!) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= -3.14 X(o=-3.1,f=-2.7) USER MOD Single : A 105 SER OG : rot -121:sc= 1.23 USER MOD Single : A 111 MET CE :methyl 151:sc= -5.41! (180deg=-10.4!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 88:sc= 0.284 USER MOD Single : A 128 GLN : amide:sc= -0.112 K(o=-0.11,f=-0.83) USER MOD Single : A 131 CYS SG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 4.142 2.576 -6.126 1.00 22.11 N ATOM 70 CA LYS A 4 5.183 3.591 -6.014 1.00 54.30 C ATOM 71 C LYS A 4 6.221 3.194 -4.970 1.00 31.32 C ATOM 72 O LYS A 4 6.648 4.017 -4.160 1.00 50.24 O ATOM 73 CB LYS A 4 4.567 4.944 -5.647 1.00 71.53 C ATOM 74 CG LYS A 4 5.349 6.132 -6.180 1.00 14.14 C ATOM 75 CD LYS A 4 5.085 7.385 -5.361 1.00 31.32 C ATOM 76 CE LYS A 4 5.308 8.645 -6.183 1.00 33.02 C ATOM 77 NZ LYS A 4 6.405 9.484 -5.626 1.00 30.32 N ATOM 0 HA LYS A 4 5.680 3.674 -6.981 1.00 54.30 H new ATOM 0 HB2 LYS A 4 3.549 4.987 -6.033 1.00 71.53 H new ATOM 0 HB3 LYS A 4 4.500 5.021 -4.562 1.00 71.53 H new ATOM 0 HG2 LYS A 4 6.415 5.904 -6.165 1.00 14.14 H new ATOM 0 HG3 LYS A 4 5.076 6.312 -7.220 1.00 14.14 H new ATOM 0 HD2 LYS A 4 4.061 7.369 -4.989 1.00 31.32 H new ATOM 0 HD3 LYS A 4 5.740 7.397 -4.490 1.00 31.32 H new ATOM 0 HE2 LYS A 4 5.547 8.371 -7.211 1.00 33.02 H new ATOM 0 HE3 LYS A 4 4.386 9.226 -6.214 1.00 33.02 H new ATOM 0 HZ1 LYS A 4 6.526 10.333 -6.214 1.00 30.32 H new ATOM 0 HZ2 LYS A 4 6.166 9.767 -4.654 1.00 30.32 H new ATOM 0 HZ3 LYS A 4 7.290 8.938 -5.620 1.00 30.32 H new ATOM 91 N ASP A 5 6.624 1.928 -4.995 1.00 14.02 N ATOM 92 CA ASP A 5 7.614 1.422 -4.052 1.00 2.02 C ATOM 93 C ASP A 5 9.029 1.678 -4.561 1.00 24.04 C ATOM 94 O ASP A 5 9.843 0.758 -4.651 1.00 32.13 O ATOM 95 CB ASP A 5 7.407 -0.075 -3.815 1.00 52.24 C ATOM 96 CG ASP A 5 6.293 -0.356 -2.826 1.00 2.22 C ATOM 97 OD1 ASP A 5 5.502 0.569 -2.545 1.00 60.54 O ATOM 98 OD2 ASP A 5 6.213 -1.500 -2.331 1.00 44.10 O ATOM 0 H ASP A 5 6.280 1.234 -5.658 1.00 14.02 H new ATOM 0 HA ASP A 5 7.485 1.952 -3.108 1.00 2.02 H new ATOM 0 HB2 ASP A 5 7.178 -0.562 -4.763 1.00 52.24 H new ATOM 0 HB3 ASP A 5 8.335 -0.513 -3.447 1.00 52.24 H new ATOM 103 N ILE A 6 9.315 2.932 -4.893 1.00 3.32 N ATOM 104 CA ILE A 6 10.632 3.308 -5.393 1.00 11.55 C ATOM 105 C ILE A 6 11.685 3.213 -4.294 1.00 31.03 C ATOM 106 O ILE A 6 11.364 3.264 -3.106 1.00 71.13 O ATOM 107 CB ILE A 6 10.630 4.739 -5.963 1.00 72.01 C ATOM 108 CG1 ILE A 6 10.331 5.752 -4.856 1.00 54.45 C ATOM 109 CG2 ILE A 6 9.613 4.859 -7.088 1.00 14.10 C ATOM 110 CD1 ILE A 6 10.425 7.191 -5.313 1.00 51.33 C ATOM 0 H ILE A 6 8.653 3.705 -4.825 1.00 3.32 H new ATOM 0 HA ILE A 6 10.878 2.607 -6.191 1.00 11.55 H new ATOM 0 HB ILE A 6 11.618 4.954 -6.369 1.00 72.01 H new ATOM 0 HG12 ILE A 6 9.330 5.568 -4.466 1.00 54.45 H new ATOM 0 HG13 ILE A 6 11.027 5.594 -4.032 1.00 54.45 H new ATOM 0 HG21 ILE A 6 9.623 5.876 -7.481 1.00 14.10 H new ATOM 0 HG22 ILE A 6 9.867 4.160 -7.885 1.00 14.10 H new ATOM 0 HG23 ILE A 6 8.619 4.628 -6.706 1.00 14.10 H new ATOM 0 HD11 ILE A 6 10.201 7.854 -4.477 1.00 51.33 H new ATOM 0 HD12 ILE A 6 11.433 7.393 -5.676 1.00 51.33 H new ATOM 0 HD13 ILE A 6 9.709 7.365 -6.116 1.00 51.33 H new ATOM 122 N ARG A 7 12.943 3.076 -4.698 1.00 64.11 N ATOM 123 CA ARG A 7 14.044 2.974 -3.748 1.00 4.11 C ATOM 124 C ARG A 7 14.692 4.337 -3.518 1.00 33.43 C ATOM 125 O ARG A 7 15.900 4.433 -3.304 1.00 64.35 O ATOM 126 CB ARG A 7 15.091 1.979 -4.252 1.00 41.03 C ATOM 127 CG ARG A 7 14.728 0.527 -3.989 1.00 32.13 C ATOM 128 CD ARG A 7 14.792 0.197 -2.506 1.00 15.14 C ATOM 129 NE ARG A 7 13.532 -0.353 -2.013 1.00 32.24 N ATOM 130 CZ ARG A 7 13.424 -1.046 -0.884 1.00 52.51 C ATOM 131 NH1 ARG A 7 14.495 -1.271 -0.136 1.00 12.34 N ATOM 132 NH2 ARG A 7 12.243 -1.514 -0.502 1.00 55.20 N ATOM 0 H ARG A 7 13.226 3.033 -5.677 1.00 64.11 H new ATOM 0 HA ARG A 7 13.640 2.618 -2.800 1.00 4.11 H new ATOM 0 HB2 ARG A 7 15.229 2.122 -5.324 1.00 41.03 H new ATOM 0 HB3 ARG A 7 16.047 2.198 -3.776 1.00 41.03 H new ATOM 0 HG2 ARG A 7 13.724 0.328 -4.364 1.00 32.13 H new ATOM 0 HG3 ARG A 7 15.408 -0.124 -4.538 1.00 32.13 H new ATOM 0 HD2 ARG A 7 15.594 -0.519 -2.328 1.00 15.14 H new ATOM 0 HD3 ARG A 7 15.039 1.098 -1.944 1.00 15.14 H new ATOM 0 HE ARG A 7 12.689 -0.197 -2.565 1.00 32.24 H new ATOM 0 HH11 ARG A 7 15.404 -0.912 -0.426 1.00 12.34 H new ATOM 0 HH12 ARG A 7 14.410 -1.803 0.730 1.00 12.34 H new ATOM 0 HH21 ARG A 7 11.417 -1.342 -1.075 1.00 55.20 H new ATOM 0 HH22 ARG A 7 12.161 -2.046 0.365 1.00 55.20 H new ATOM 146 N ASP A 8 13.879 5.387 -3.563 1.00 24.31 N ATOM 147 CA ASP A 8 14.372 6.744 -3.359 1.00 23.02 C ATOM 148 C ASP A 8 15.373 7.128 -4.445 1.00 34.23 C ATOM 149 O ASP A 8 16.450 7.648 -4.154 1.00 62.04 O ATOM 150 CB ASP A 8 15.023 6.871 -1.980 1.00 50.25 C ATOM 151 CG ASP A 8 14.279 6.091 -0.915 1.00 14.44 C ATOM 152 OD1 ASP A 8 13.127 6.462 -0.604 1.00 63.34 O ATOM 153 OD2 ASP A 8 14.848 5.111 -0.390 1.00 12.11 O ATOM 0 H ASP A 8 12.876 5.324 -3.739 1.00 24.31 H new ATOM 0 HA ASP A 8 13.523 7.425 -3.416 1.00 23.02 H new ATOM 0 HB2 ASP A 8 16.052 6.517 -2.033 1.00 50.25 H new ATOM 0 HB3 ASP A 8 15.062 7.922 -1.695 1.00 50.25 H new ATOM 158 N TYR A 9 15.009 6.867 -5.695 1.00 42.04 N ATOM 159 CA TYR A 9 15.876 7.182 -6.825 1.00 21.24 C ATOM 160 C TYR A 9 17.250 6.542 -6.652 1.00 22.24 C ATOM 161 O TYR A 9 18.269 7.124 -7.019 1.00 43.55 O ATOM 162 CB TYR A 9 16.022 8.697 -6.976 1.00 23.05 C ATOM 163 CG TYR A 9 14.712 9.445 -6.872 1.00 63.12 C ATOM 164 CD1 TYR A 9 14.182 9.789 -5.635 1.00 51.42 C ATOM 165 CD2 TYR A 9 14.005 9.808 -8.012 1.00 45.01 C ATOM 166 CE1 TYR A 9 12.985 10.472 -5.536 1.00 41.12 C ATOM 167 CE2 TYR A 9 12.809 10.492 -7.923 1.00 14.13 C ATOM 168 CZ TYR A 9 12.302 10.821 -6.683 1.00 3.33 C ATOM 169 OH TYR A 9 11.110 11.503 -6.588 1.00 64.44 O ATOM 0 H TYR A 9 14.120 6.438 -5.952 1.00 42.04 H new ATOM 0 HA TYR A 9 15.417 6.776 -7.727 1.00 21.24 H new ATOM 0 HB2 TYR A 9 16.703 9.066 -6.209 1.00 23.05 H new ATOM 0 HB3 TYR A 9 16.480 8.915 -7.941 1.00 23.05 H new ATOM 0 HD1 TYR A 9 14.715 9.518 -4.735 1.00 51.42 H new ATOM 0 HD2 TYR A 9 14.398 9.551 -8.984 1.00 45.01 H new ATOM 0 HE1 TYR A 9 12.586 10.731 -4.566 1.00 41.12 H new ATOM 0 HE2 TYR A 9 12.273 10.768 -8.819 1.00 14.13 H new ATOM 0 HH TYR A 9 10.758 11.673 -7.487 1.00 64.44 H new ATOM 179 N ASN A 10 17.268 5.338 -6.089 1.00 22.20 N ATOM 180 CA ASN A 10 18.516 4.617 -5.866 1.00 63.25 C ATOM 181 C ASN A 10 18.721 3.543 -6.931 1.00 23.13 C ATOM 182 O ASN A 10 19.533 3.705 -7.842 1.00 72.22 O ATOM 183 CB ASN A 10 18.520 3.980 -4.475 1.00 63.55 C ATOM 184 CG ASN A 10 19.776 3.171 -4.213 1.00 44.35 C ATOM 185 OD1 ASN A 10 20.892 3.663 -4.387 1.00 33.10 O ATOM 186 ND2 ASN A 10 19.600 1.924 -3.793 1.00 63.14 N ATOM 0 H ASN A 10 16.433 4.841 -5.779 1.00 22.20 H new ATOM 0 HA ASN A 10 19.337 5.331 -5.933 1.00 63.25 H new ATOM 0 HB2 ASN A 10 18.430 4.761 -3.720 1.00 63.55 H new ATOM 0 HB3 ASN A 10 17.647 3.335 -4.371 1.00 63.55 H new ATOM 0 HD21 ASN A 10 20.408 1.332 -3.601 1.00 63.14 H new ATOM 0 HD22 ASN A 10 18.657 1.558 -3.663 1.00 63.14 H new ATOM 193 N ASP A 11 17.980 2.447 -6.808 1.00 40.41 N ATOM 194 CA ASP A 11 18.079 1.347 -7.760 1.00 54.10 C ATOM 195 C ASP A 11 17.027 0.281 -7.469 1.00 24.33 C ATOM 196 O ASP A 11 17.357 -0.879 -7.224 1.00 21.40 O ATOM 197 CB ASP A 11 19.477 0.729 -7.714 1.00 73.42 C ATOM 198 CG ASP A 11 19.781 -0.106 -8.943 1.00 4.41 C ATOM 199 OD1 ASP A 11 18.860 -0.786 -9.441 1.00 43.51 O ATOM 200 OD2 ASP A 11 20.941 -0.079 -9.406 1.00 22.12 O ATOM 0 H ASP A 11 17.304 2.297 -6.059 1.00 40.41 H new ATOM 0 HA ASP A 11 17.900 1.745 -8.759 1.00 54.10 H new ATOM 0 HB2 ASP A 11 20.219 1.522 -7.624 1.00 73.42 H new ATOM 0 HB3 ASP A 11 19.567 0.106 -6.824 1.00 73.42 H new ATOM 205 N ALA A 12 15.761 0.682 -7.496 1.00 11.50 N ATOM 206 CA ALA A 12 14.661 -0.239 -7.236 1.00 5.52 C ATOM 207 C ALA A 12 14.499 -1.236 -8.378 1.00 12.30 C ATOM 208 O ALA A 12 13.964 -2.328 -8.189 1.00 74.33 O ATOM 209 CB ALA A 12 13.368 0.532 -7.017 1.00 51.11 C ATOM 0 H ALA A 12 15.471 1.639 -7.695 1.00 11.50 H new ATOM 0 HA ALA A 12 14.894 -0.799 -6.330 1.00 5.52 H new ATOM 0 HB1 ALA A 12 12.555 -0.168 -6.824 1.00 51.11 H new ATOM 0 HB2 ALA A 12 13.483 1.199 -6.163 1.00 51.11 H new ATOM 0 HB3 ALA A 12 13.139 1.118 -7.907 1.00 51.11 H new ATOM 215 N ASP A 13 14.963 -0.852 -9.562 1.00 72.42 N ATOM 216 CA ASP A 13 14.869 -1.714 -10.735 1.00 51.54 C ATOM 217 C ASP A 13 15.523 -3.066 -10.470 1.00 71.05 C ATOM 218 O ASP A 13 15.173 -4.068 -11.093 1.00 70.13 O ATOM 219 CB ASP A 13 15.528 -1.042 -11.941 1.00 54.04 C ATOM 220 CG ASP A 13 17.020 -0.851 -11.754 1.00 71.44 C ATOM 221 OD1 ASP A 13 17.756 -1.860 -11.791 1.00 15.33 O ATOM 222 OD2 ASP A 13 17.452 0.306 -11.571 1.00 22.02 O ATOM 0 H ASP A 13 15.408 0.050 -9.735 1.00 72.42 H new ATOM 0 HA ASP A 13 13.813 -1.878 -10.952 1.00 51.54 H new ATOM 0 HB2 ASP A 13 15.351 -1.645 -12.831 1.00 54.04 H new ATOM 0 HB3 ASP A 13 15.060 -0.073 -12.114 1.00 54.04 H new ATOM 227 N MET A 14 16.475 -3.086 -9.543 1.00 53.22 N ATOM 228 CA MET A 14 17.177 -4.316 -9.196 1.00 45.42 C ATOM 229 C MET A 14 16.247 -5.291 -8.482 1.00 52.40 C ATOM 230 O MET A 14 16.502 -6.494 -8.446 1.00 43.25 O ATOM 231 CB MET A 14 18.386 -4.005 -8.311 1.00 63.13 C ATOM 232 CG MET A 14 19.717 -4.358 -8.955 1.00 43.32 C ATOM 233 SD MET A 14 19.873 -6.119 -9.309 1.00 53.25 S ATOM 234 CE MET A 14 20.827 -6.666 -7.896 1.00 45.51 C ATOM 0 H MET A 14 16.778 -2.265 -9.019 1.00 53.22 H new ATOM 0 HA MET A 14 17.521 -4.781 -10.120 1.00 45.42 H new ATOM 0 HB2 MET A 14 18.381 -2.943 -8.064 1.00 63.13 H new ATOM 0 HB3 MET A 14 18.289 -4.551 -7.373 1.00 63.13 H new ATOM 0 HG2 MET A 14 19.829 -3.794 -9.881 1.00 43.32 H new ATOM 0 HG3 MET A 14 20.528 -4.051 -8.295 1.00 43.32 H new ATOM 0 HE1 MET A 14 21.006 -7.739 -7.971 1.00 45.51 H new ATOM 0 HE2 MET A 14 21.781 -6.140 -7.875 1.00 45.51 H new ATOM 0 HE3 MET A 14 20.276 -6.453 -6.980 1.00 45.51 H new ATOM 244 N ALA A 15 15.167 -4.763 -7.914 1.00 62.13 N ATOM 245 CA ALA A 15 14.198 -5.587 -7.203 1.00 23.42 C ATOM 246 C ALA A 15 13.418 -6.474 -8.168 1.00 23.15 C ATOM 247 O ALA A 15 12.897 -7.520 -7.781 1.00 13.15 O ATOM 248 CB ALA A 15 13.247 -4.711 -6.402 1.00 13.11 C ATOM 0 H ALA A 15 14.942 -3.768 -7.933 1.00 62.13 H new ATOM 0 HA ALA A 15 14.743 -6.234 -6.516 1.00 23.42 H new ATOM 0 HB1 ALA A 15 12.529 -5.340 -5.876 1.00 13.11 H new ATOM 0 HB2 ALA A 15 13.814 -4.125 -5.679 1.00 13.11 H new ATOM 0 HB3 ALA A 15 12.716 -4.039 -7.076 1.00 13.11 H new ATOM 254 N ARG A 16 13.342 -6.049 -9.424 1.00 62.25 N ATOM 255 CA ARG A 16 12.624 -6.804 -10.444 1.00 71.30 C ATOM 256 C ARG A 16 13.094 -8.255 -10.478 1.00 64.42 C ATOM 257 O ARG A 16 12.336 -9.157 -10.839 1.00 2.23 O ATOM 258 CB ARG A 16 12.820 -6.161 -11.818 1.00 53.11 C ATOM 259 CG ARG A 16 11.817 -5.061 -12.124 1.00 54.20 C ATOM 260 CD ARG A 16 11.846 -3.970 -11.065 1.00 11.11 C ATOM 261 NE ARG A 16 11.027 -2.821 -11.440 1.00 52.53 N ATOM 262 CZ ARG A 16 10.988 -1.688 -10.747 1.00 44.24 C ATOM 263 NH1 ARG A 16 11.719 -1.553 -9.649 1.00 62.53 N ATOM 264 NH2 ARG A 16 10.218 -0.686 -11.153 1.00 21.41 N ATOM 0 H ARG A 16 13.769 -5.186 -9.760 1.00 62.25 H new ATOM 0 HA ARG A 16 11.564 -6.789 -10.192 1.00 71.30 H new ATOM 0 HB2 ARG A 16 13.827 -5.749 -11.877 1.00 53.11 H new ATOM 0 HB3 ARG A 16 12.746 -6.932 -12.585 1.00 53.11 H new ATOM 0 HG2 ARG A 16 12.037 -4.628 -13.100 1.00 54.20 H new ATOM 0 HG3 ARG A 16 10.815 -5.487 -12.182 1.00 54.20 H new ATOM 0 HD2 ARG A 16 11.490 -4.375 -10.118 1.00 11.11 H new ATOM 0 HD3 ARG A 16 12.875 -3.646 -10.907 1.00 11.11 H new ATOM 0 HE ARG A 16 10.453 -2.892 -12.280 1.00 52.53 H new ATOM 0 HH11 ARG A 16 12.313 -2.320 -9.334 1.00 62.53 H new ATOM 0 HH12 ARG A 16 11.687 -0.682 -9.119 1.00 62.53 H new ATOM 0 HH21 ARG A 16 9.655 -0.785 -11.998 1.00 21.41 H new ATOM 0 HH22 ARG A 16 10.189 0.183 -10.620 1.00 21.41 H new ATOM 278 N LEU A 17 14.349 -8.474 -10.101 1.00 44.15 N ATOM 279 CA LEU A 17 14.922 -9.816 -10.089 1.00 51.42 C ATOM 280 C LEU A 17 14.031 -10.781 -9.314 1.00 53.13 C ATOM 281 O LEU A 17 14.011 -11.981 -9.590 1.00 33.44 O ATOM 282 CB LEU A 17 16.321 -9.789 -9.472 1.00 44.42 C ATOM 283 CG LEU A 17 16.381 -9.794 -7.944 1.00 65.53 C ATOM 284 CD1 LEU A 17 16.439 -11.220 -7.418 1.00 35.12 C ATOM 285 CD2 LEU A 17 17.580 -8.995 -7.455 1.00 0.24 C ATOM 0 H LEU A 17 14.989 -7.740 -9.800 1.00 44.15 H new ATOM 0 HA LEU A 17 14.993 -10.163 -11.120 1.00 51.42 H new ATOM 0 HB2 LEU A 17 16.875 -10.652 -9.840 1.00 44.42 H new ATOM 0 HB3 LEU A 17 16.838 -8.900 -9.833 1.00 44.42 H new ATOM 0 HG LEU A 17 15.475 -9.323 -7.562 1.00 65.53 H new ATOM 0 HD11 LEU A 17 16.481 -11.205 -6.329 1.00 35.12 H new ATOM 0 HD12 LEU A 17 15.550 -11.763 -7.739 1.00 35.12 H new ATOM 0 HD13 LEU A 17 17.328 -11.716 -7.809 1.00 35.12 H new ATOM 0 HD21 LEU A 17 17.607 -9.009 -6.365 1.00 0.24 H new ATOM 0 HD22 LEU A 17 18.496 -9.437 -7.846 1.00 0.24 H new ATOM 0 HD23 LEU A 17 17.497 -7.965 -7.802 1.00 0.24 H new ATOM 297 N LEU A 18 13.293 -10.249 -8.346 1.00 21.10 N ATOM 298 CA LEU A 18 12.397 -11.063 -7.532 1.00 11.00 C ATOM 299 C LEU A 18 11.482 -11.910 -8.410 1.00 61.35 C ATOM 300 O LEU A 18 11.200 -13.066 -8.096 1.00 25.02 O ATOM 301 CB LEU A 18 11.559 -10.171 -6.614 1.00 31.41 C ATOM 302 CG LEU A 18 12.097 -9.974 -5.196 1.00 73.12 C ATOM 303 CD1 LEU A 18 11.578 -8.672 -4.605 1.00 62.40 C ATOM 304 CD2 LEU A 18 11.716 -11.153 -4.312 1.00 55.33 C ATOM 0 H LEU A 18 13.297 -9.258 -8.106 1.00 21.10 H new ATOM 0 HA LEU A 18 13.006 -11.731 -6.923 1.00 11.00 H new ATOM 0 HB2 LEU A 18 11.460 -9.192 -7.083 1.00 31.41 H new ATOM 0 HB3 LEU A 18 10.557 -10.594 -6.545 1.00 31.41 H new ATOM 0 HG LEU A 18 13.185 -9.919 -5.245 1.00 73.12 H new ATOM 0 HD11 LEU A 18 11.971 -8.548 -3.596 1.00 62.40 H new ATOM 0 HD12 LEU A 18 11.902 -7.836 -5.225 1.00 62.40 H new ATOM 0 HD13 LEU A 18 10.489 -8.697 -4.570 1.00 62.40 H new ATOM 0 HD21 LEU A 18 12.107 -10.996 -3.307 1.00 55.33 H new ATOM 0 HD22 LEU A 18 10.630 -11.240 -4.269 1.00 55.33 H new ATOM 0 HD23 LEU A 18 12.137 -12.069 -4.726 1.00 55.33 H new ATOM 316 N GLU A 19 11.024 -11.327 -9.514 1.00 35.52 N ATOM 317 CA GLU A 19 10.142 -12.030 -10.438 1.00 73.52 C ATOM 318 C GLU A 19 10.732 -13.382 -10.832 1.00 14.34 C ATOM 319 O GLU A 19 10.001 -14.328 -11.123 1.00 15.23 O ATOM 320 CB GLU A 19 9.899 -11.184 -11.689 1.00 54.05 C ATOM 321 CG GLU A 19 8.552 -11.439 -12.344 1.00 55.25 C ATOM 322 CD GLU A 19 8.599 -12.566 -13.357 1.00 62.33 C ATOM 323 OE1 GLU A 19 9.652 -13.232 -13.454 1.00 14.02 O ATOM 324 OE2 GLU A 19 7.585 -12.783 -14.053 1.00 43.11 O ATOM 0 H GLU A 19 11.249 -10.371 -9.790 1.00 35.52 H new ATOM 0 HA GLU A 19 9.191 -12.201 -9.933 1.00 73.52 H new ATOM 0 HB2 GLU A 19 9.971 -10.129 -11.424 1.00 54.05 H new ATOM 0 HB3 GLU A 19 10.689 -11.385 -12.412 1.00 54.05 H new ATOM 0 HG2 GLU A 19 7.818 -11.678 -11.575 1.00 55.25 H new ATOM 0 HG3 GLU A 19 8.213 -10.527 -12.836 1.00 55.25 H new ATOM 331 N GLN A 20 12.058 -13.462 -10.838 1.00 23.30 N ATOM 332 CA GLN A 20 12.746 -14.697 -11.197 1.00 4.32 C ATOM 333 C GLN A 20 12.244 -15.865 -10.354 1.00 44.51 C ATOM 334 O GLN A 20 12.294 -17.018 -10.782 1.00 2.30 O ATOM 335 CB GLN A 20 14.257 -14.534 -11.017 1.00 33.43 C ATOM 336 CG GLN A 20 15.078 -15.449 -11.911 1.00 51.12 C ATOM 337 CD GLN A 20 16.178 -16.169 -11.157 1.00 3.31 C ATOM 338 OE1 GLN A 20 16.932 -15.556 -10.400 1.00 50.55 O ATOM 339 NE2 GLN A 20 16.277 -17.477 -11.359 1.00 73.51 N ATOM 0 H GLN A 20 12.677 -12.688 -10.599 1.00 23.30 H new ATOM 0 HA GLN A 20 12.533 -14.911 -12.244 1.00 4.32 H new ATOM 0 HB2 GLN A 20 14.529 -13.499 -11.223 1.00 33.43 H new ATOM 0 HB3 GLN A 20 14.514 -14.731 -9.976 1.00 33.43 H new ATOM 0 HG2 GLN A 20 14.420 -16.184 -12.375 1.00 51.12 H new ATOM 0 HG3 GLN A 20 15.519 -14.863 -12.717 1.00 51.12 H new ATOM 0 HE21 GLN A 20 15.631 -17.945 -11.995 1.00 73.51 H new ATOM 0 HE22 GLN A 20 16.999 -18.014 -10.878 1.00 73.51 H new ATOM 348 N TRP A 21 11.762 -15.558 -9.155 1.00 40.14 N ATOM 349 CA TRP A 21 11.251 -16.583 -8.252 1.00 42.12 C ATOM 350 C TRP A 21 10.227 -17.467 -8.955 1.00 51.34 C ATOM 351 O TRP A 21 10.206 -18.682 -8.762 1.00 45.31 O ATOM 352 CB TRP A 21 10.622 -15.936 -7.017 1.00 25.00 C ATOM 353 CG TRP A 21 10.204 -16.928 -5.975 1.00 21.53 C ATOM 354 CD1 TRP A 21 8.981 -17.524 -5.854 1.00 11.31 C ATOM 355 CD2 TRP A 21 11.008 -17.439 -4.906 1.00 24.21 C ATOM 356 NE1 TRP A 21 8.976 -18.374 -4.774 1.00 43.23 N ATOM 357 CE2 TRP A 21 10.208 -18.341 -4.177 1.00 4.44 C ATOM 358 CE3 TRP A 21 12.327 -17.225 -4.495 1.00 53.42 C ATOM 359 CZ2 TRP A 21 10.685 -19.024 -3.061 1.00 10.41 C ATOM 360 CZ3 TRP A 21 12.798 -17.903 -3.387 1.00 41.14 C ATOM 361 CH2 TRP A 21 11.979 -18.794 -2.681 1.00 64.20 C ATOM 0 H TRP A 21 11.714 -14.608 -8.786 1.00 40.14 H new ATOM 0 HA TRP A 21 12.088 -17.207 -7.940 1.00 42.12 H new ATOM 0 HB2 TRP A 21 11.335 -15.238 -6.578 1.00 25.00 H new ATOM 0 HB3 TRP A 21 9.753 -15.354 -7.323 1.00 25.00 H new ATOM 0 HD1 TRP A 21 8.141 -17.352 -6.511 1.00 11.31 H new ATOM 0 HE1 TRP A 21 8.183 -18.938 -4.467 1.00 43.23 H new ATOM 0 HE3 TRP A 21 12.967 -16.542 -5.034 1.00 53.42 H new ATOM 0 HZ2 TRP A 21 10.056 -19.711 -2.515 1.00 10.41 H new ATOM 0 HZ3 TRP A 21 13.815 -17.743 -3.060 1.00 41.14 H new ATOM 0 HH2 TRP A 21 12.377 -19.310 -1.820 1.00 64.20 H new ATOM 372 N GLU A 22 9.379 -16.848 -9.772 1.00 21.43 N ATOM 373 CA GLU A 22 8.352 -17.581 -10.503 1.00 30.13 C ATOM 374 C GLU A 22 8.978 -18.494 -11.553 1.00 42.44 C ATOM 375 O GLU A 22 8.914 -19.718 -11.447 1.00 23.55 O ATOM 376 CB GLU A 22 7.378 -16.608 -11.171 1.00 64.33 C ATOM 377 CG GLU A 22 6.079 -17.257 -11.616 1.00 74.41 C ATOM 378 CD GLU A 22 5.184 -17.630 -10.450 1.00 54.30 C ATOM 379 OE1 GLU A 22 5.653 -17.561 -9.295 1.00 43.32 O ATOM 380 OE2 GLU A 22 4.013 -17.990 -10.693 1.00 53.12 O ATOM 0 H GLU A 22 9.383 -15.843 -9.944 1.00 21.43 H new ATOM 0 HA GLU A 22 7.805 -18.199 -9.790 1.00 30.13 H new ATOM 0 HB2 GLU A 22 7.151 -15.800 -10.476 1.00 64.33 H new ATOM 0 HB3 GLU A 22 7.864 -16.157 -12.036 1.00 64.33 H new ATOM 0 HG2 GLU A 22 5.544 -16.575 -12.276 1.00 74.41 H new ATOM 0 HG3 GLU A 22 6.304 -18.151 -12.197 1.00 74.41 H new ATOM 387 N LYS A 23 9.583 -17.888 -12.569 1.00 44.24 N ATOM 388 CA LYS A 23 10.223 -18.643 -13.640 1.00 75.23 C ATOM 389 C LYS A 23 9.211 -19.532 -14.358 1.00 4.23 C ATOM 390 O LYS A 23 9.571 -20.563 -14.927 1.00 14.15 O ATOM 391 CB LYS A 23 11.362 -19.498 -13.080 1.00 15.11 C ATOM 392 CG LYS A 23 12.333 -19.987 -14.140 1.00 20.30 C ATOM 393 CD LYS A 23 12.898 -21.354 -13.790 1.00 42.22 C ATOM 394 CE LYS A 23 12.358 -22.434 -14.715 1.00 40.31 C ATOM 395 NZ LYS A 23 13.269 -23.609 -14.787 1.00 21.45 N ATOM 0 H LYS A 23 9.644 -16.875 -12.673 1.00 44.24 H new ATOM 0 HA LYS A 23 10.631 -17.932 -14.359 1.00 75.23 H new ATOM 0 HB2 LYS A 23 11.910 -18.917 -12.338 1.00 15.11 H new ATOM 0 HB3 LYS A 23 10.938 -20.359 -12.562 1.00 15.11 H new ATOM 0 HG2 LYS A 23 11.826 -20.038 -15.104 1.00 20.30 H new ATOM 0 HG3 LYS A 23 13.148 -19.271 -14.246 1.00 20.30 H new ATOM 0 HD2 LYS A 23 13.986 -21.327 -13.856 1.00 42.22 H new ATOM 0 HD3 LYS A 23 12.648 -21.599 -12.758 1.00 42.22 H new ATOM 0 HE2 LYS A 23 11.377 -22.756 -14.364 1.00 40.31 H new ATOM 0 HE3 LYS A 23 12.219 -22.020 -15.714 1.00 40.31 H new ATOM 0 HZ1 LYS A 23 12.865 -24.322 -15.427 1.00 21.45 H new ATOM 0 HZ2 LYS A 23 14.197 -23.307 -15.146 1.00 21.45 H new ATOM 0 HZ3 LYS A 23 13.382 -24.020 -13.838 1.00 21.45 H new ATOM 409 N ASP A 24 7.947 -19.125 -14.328 1.00 2.01 N ATOM 410 CA ASP A 24 6.884 -19.883 -14.978 1.00 25.23 C ATOM 411 C ASP A 24 6.945 -19.715 -16.493 1.00 23.33 C ATOM 412 O ASP A 24 6.520 -20.595 -17.242 1.00 44.33 O ATOM 413 CB ASP A 24 5.518 -19.436 -14.457 1.00 12.30 C ATOM 414 CG ASP A 24 4.968 -20.370 -13.397 1.00 52.12 C ATOM 415 OD1 ASP A 24 5.196 -21.593 -13.507 1.00 43.14 O ATOM 416 OD2 ASP A 24 4.310 -19.878 -12.457 1.00 54.11 O ATOM 0 H ASP A 24 7.633 -18.274 -13.861 1.00 2.01 H new ATOM 0 HA ASP A 24 7.027 -20.937 -14.742 1.00 25.23 H new ATOM 0 HB2 ASP A 24 5.601 -18.431 -14.043 1.00 12.30 H new ATOM 0 HB3 ASP A 24 4.815 -19.381 -15.289 1.00 12.30 H new ATOM 421 N ASP A 25 7.475 -18.581 -16.936 1.00 40.41 N ATOM 422 CA ASP A 25 7.591 -18.297 -18.362 1.00 5.12 C ATOM 423 C ASP A 25 6.222 -18.318 -19.034 1.00 21.52 C ATOM 424 O ASP A 25 6.071 -18.834 -20.142 1.00 23.15 O ATOM 425 CB ASP A 25 8.518 -19.313 -19.032 1.00 1.34 C ATOM 426 CG ASP A 25 9.331 -18.702 -20.156 1.00 1.51 C ATOM 427 OD1 ASP A 25 9.686 -17.509 -20.051 1.00 43.41 O ATOM 428 OD2 ASP A 25 9.613 -19.416 -21.140 1.00 71.21 O ATOM 0 H ASP A 25 7.831 -17.843 -16.329 1.00 40.41 H new ATOM 0 HA ASP A 25 8.015 -17.299 -18.475 1.00 5.12 H new ATOM 0 HB2 ASP A 25 9.193 -19.732 -18.286 1.00 1.34 H new ATOM 0 HB3 ASP A 25 7.924 -20.139 -19.424 1.00 1.34 H new ATOM 433 N ASP A 26 5.227 -17.757 -18.356 1.00 44.50 N ATOM 434 CA ASP A 26 3.870 -17.711 -18.887 1.00 60.12 C ATOM 435 C ASP A 26 3.847 -17.055 -20.264 1.00 61.13 C ATOM 436 O ASP A 26 2.993 -17.364 -21.095 1.00 55.14 O ATOM 437 CB ASP A 26 2.950 -16.950 -17.931 1.00 24.32 C ATOM 438 CG ASP A 26 1.574 -17.577 -17.830 1.00 32.32 C ATOM 439 OD1 ASP A 26 0.997 -17.916 -18.885 1.00 20.24 O ATOM 440 OD2 ASP A 26 1.074 -17.730 -16.696 1.00 54.20 O ATOM 0 H ASP A 26 5.335 -17.328 -17.437 1.00 44.50 H new ATOM 0 HA ASP A 26 3.511 -18.735 -18.986 1.00 60.12 H new ATOM 0 HB2 ASP A 26 3.405 -16.919 -16.941 1.00 24.32 H new ATOM 0 HB3 ASP A 26 2.852 -15.919 -18.270 1.00 24.32 H new ATOM 445 N ILE A 27 4.790 -16.149 -20.498 1.00 10.41 N ATOM 446 CA ILE A 27 4.877 -15.449 -21.774 1.00 24.51 C ATOM 447 C ILE A 27 6.074 -15.934 -22.586 1.00 31.34 C ATOM 448 O ILE A 27 7.136 -16.220 -22.033 1.00 52.43 O ATOM 449 CB ILE A 27 4.990 -13.926 -21.575 1.00 33.42 C ATOM 450 CG1 ILE A 27 3.795 -13.406 -20.773 1.00 3.51 C ATOM 451 CG2 ILE A 27 5.079 -13.222 -22.920 1.00 43.41 C ATOM 452 CD1 ILE A 27 2.466 -13.614 -21.464 1.00 61.12 C ATOM 0 H ILE A 27 5.505 -15.882 -19.821 1.00 10.41 H new ATOM 0 HA ILE A 27 3.958 -15.669 -22.317 1.00 24.51 H new ATOM 0 HB ILE A 27 5.900 -13.713 -21.015 1.00 33.42 H new ATOM 0 HG12 ILE A 27 3.773 -13.905 -19.804 1.00 3.51 H new ATOM 0 HG13 ILE A 27 3.932 -12.342 -20.581 1.00 3.51 H new ATOM 0 HG21 ILE A 27 5.158 -12.146 -22.763 1.00 43.41 H new ATOM 0 HG22 ILE A 27 5.958 -13.576 -23.458 1.00 43.41 H new ATOM 0 HG23 ILE A 27 4.184 -13.438 -23.504 1.00 43.41 H new ATOM 0 HD11 ILE A 27 1.665 -13.221 -20.838 1.00 61.12 H new ATOM 0 HD12 ILE A 27 2.468 -13.092 -22.421 1.00 61.12 H new ATOM 0 HD13 ILE A 27 2.306 -14.679 -21.632 1.00 61.12 H new ATOM 1035 N THR A 64 18.162 4.496 -23.734 1.00 2.14 N ATOM 1036 CA THR A 64 16.746 4.771 -23.528 1.00 32.44 C ATOM 1037 C THR A 64 16.170 3.891 -22.423 1.00 43.42 C ATOM 1038 O THR A 64 16.718 2.834 -22.109 1.00 20.15 O ATOM 1039 CB THR A 64 15.937 4.548 -24.819 1.00 73.03 C ATOM 1040 OG1 THR A 64 16.007 3.172 -25.211 1.00 1.44 O ATOM 1041 CG2 THR A 64 16.460 5.428 -25.944 1.00 64.13 C ATOM 0 HA THR A 64 16.667 5.818 -23.234 1.00 32.44 H new ATOM 0 HB THR A 64 14.899 4.816 -24.621 1.00 73.03 H new ATOM 0 HG1 THR A 64 15.489 3.039 -26.032 1.00 1.44 H new ATOM 0 HG21 THR A 64 15.873 5.253 -26.846 1.00 64.13 H new ATOM 0 HG22 THR A 64 16.377 6.476 -25.655 1.00 64.13 H new ATOM 0 HG23 THR A 64 17.505 5.187 -26.139 1.00 64.13 H new ATOM 1049 N LEU A 65 15.063 4.334 -21.838 1.00 30.01 N ATOM 1050 CA LEU A 65 14.412 3.586 -20.768 1.00 11.22 C ATOM 1051 C LEU A 65 12.946 3.325 -21.100 1.00 23.31 C ATOM 1052 O LEU A 65 12.163 4.258 -21.271 1.00 73.15 O ATOM 1053 CB LEU A 65 14.519 4.350 -19.447 1.00 11.11 C ATOM 1054 CG LEU A 65 13.520 3.953 -18.359 1.00 51.53 C ATOM 1055 CD1 LEU A 65 14.188 3.959 -16.993 1.00 60.21 C ATOM 1056 CD2 LEU A 65 12.319 4.888 -18.371 1.00 42.35 C ATOM 0 H LEU A 65 14.597 5.207 -22.086 1.00 30.01 H new ATOM 0 HA LEU A 65 14.919 2.626 -20.668 1.00 11.22 H new ATOM 0 HB2 LEU A 65 15.527 4.216 -19.053 1.00 11.11 H new ATOM 0 HB3 LEU A 65 14.397 5.413 -19.654 1.00 11.11 H new ATOM 0 HG LEU A 65 13.170 2.941 -18.565 1.00 51.53 H new ATOM 0 HD11 LEU A 65 13.462 3.674 -16.232 1.00 60.21 H new ATOM 0 HD12 LEU A 65 15.015 3.249 -16.989 1.00 60.21 H new ATOM 0 HD13 LEU A 65 14.567 4.958 -16.777 1.00 60.21 H new ATOM 0 HD21 LEU A 65 11.619 4.591 -17.591 1.00 42.35 H new ATOM 0 HD22 LEU A 65 12.652 5.910 -18.190 1.00 42.35 H new ATOM 0 HD23 LEU A 65 11.825 4.834 -19.341 1.00 42.35 H new ATOM 1068 N MET A 66 12.583 2.049 -21.187 1.00 0.32 N ATOM 1069 CA MET A 66 11.210 1.665 -21.495 1.00 3.33 C ATOM 1070 C MET A 66 10.980 0.186 -21.200 1.00 43.42 C ATOM 1071 O MET A 66 11.652 -0.679 -21.760 1.00 62.15 O ATOM 1072 CB MET A 66 10.892 1.961 -22.962 1.00 24.32 C ATOM 1073 CG MET A 66 9.423 1.789 -23.312 1.00 1.24 C ATOM 1074 SD MET A 66 9.058 2.244 -25.018 1.00 32.51 S ATOM 1075 CE MET A 66 8.296 3.848 -24.785 1.00 63.04 C ATOM 0 H MET A 66 13.220 1.264 -21.049 1.00 0.32 H new ATOM 0 HA MET A 66 10.544 2.251 -20.862 1.00 3.33 H new ATOM 0 HB2 MET A 66 11.195 2.983 -23.192 1.00 24.32 H new ATOM 0 HB3 MET A 66 11.487 1.302 -23.594 1.00 24.32 H new ATOM 0 HG2 MET A 66 9.133 0.751 -23.147 1.00 1.24 H new ATOM 0 HG3 MET A 66 8.819 2.399 -22.640 1.00 1.24 H new ATOM 0 HE1 MET A 66 8.288 4.388 -25.732 1.00 63.04 H new ATOM 0 HE2 MET A 66 7.273 3.717 -24.434 1.00 63.04 H new ATOM 0 HE3 MET A 66 8.863 4.416 -24.048 1.00 63.04 H new ATOM 1085 N MET A 67 10.027 -0.095 -20.318 1.00 24.52 N ATOM 1086 CA MET A 67 9.709 -1.470 -19.950 1.00 61.43 C ATOM 1087 C MET A 67 8.274 -1.580 -19.444 1.00 42.35 C ATOM 1088 O MET A 67 7.798 -0.716 -18.708 1.00 54.43 O ATOM 1089 CB MET A 67 10.679 -1.972 -18.879 1.00 65.23 C ATOM 1090 CG MET A 67 10.774 -3.488 -18.807 1.00 41.41 C ATOM 1091 SD MET A 67 12.418 -4.059 -18.338 1.00 25.34 S ATOM 1092 CE MET A 67 13.398 -3.427 -19.698 1.00 33.34 C ATOM 0 H MET A 67 9.462 0.610 -19.845 1.00 24.52 H new ATOM 0 HA MET A 67 9.810 -2.090 -20.841 1.00 61.43 H new ATOM 0 HB2 MET A 67 11.670 -1.563 -19.077 1.00 65.23 H new ATOM 0 HB3 MET A 67 10.365 -1.589 -17.908 1.00 65.23 H new ATOM 0 HG2 MET A 67 10.045 -3.860 -18.087 1.00 41.41 H new ATOM 0 HG3 MET A 67 10.509 -3.911 -19.776 1.00 41.41 H new ATOM 0 HE1 MET A 67 13.995 -4.234 -20.122 1.00 33.34 H new ATOM 0 HE2 MET A 67 12.738 -3.022 -20.465 1.00 33.34 H new ATOM 0 HE3 MET A 67 14.058 -2.639 -19.335 1.00 33.34 H new ATOM 1102 N PHE A 68 7.590 -2.647 -19.844 1.00 43.42 N ATOM 1103 CA PHE A 68 6.209 -2.868 -19.432 1.00 40.21 C ATOM 1104 C PHE A 68 5.937 -4.354 -19.218 1.00 12.25 C ATOM 1105 O PHE A 68 6.053 -5.158 -20.143 1.00 1.24 O ATOM 1106 CB PHE A 68 5.246 -2.307 -20.481 1.00 32.44 C ATOM 1107 CG PHE A 68 5.678 -0.984 -21.045 1.00 71.54 C ATOM 1108 CD1 PHE A 68 5.551 0.177 -20.300 1.00 73.31 C ATOM 1109 CD2 PHE A 68 6.212 -0.902 -22.321 1.00 72.12 C ATOM 1110 CE1 PHE A 68 5.947 1.395 -20.818 1.00 11.31 C ATOM 1111 CE2 PHE A 68 6.610 0.314 -22.844 1.00 62.22 C ATOM 1112 CZ PHE A 68 6.478 1.464 -22.091 1.00 24.21 C ATOM 0 H PHE A 68 7.970 -3.372 -20.453 1.00 43.42 H new ATOM 0 HA PHE A 68 6.050 -2.348 -18.487 1.00 40.21 H new ATOM 0 HB2 PHE A 68 5.149 -3.026 -21.295 1.00 32.44 H new ATOM 0 HB3 PHE A 68 4.258 -2.197 -20.034 1.00 32.44 H new ATOM 0 HD1 PHE A 68 5.138 0.129 -19.303 1.00 73.31 H new ATOM 0 HD2 PHE A 68 6.318 -1.799 -22.914 1.00 72.12 H new ATOM 0 HE1 PHE A 68 5.841 2.293 -20.227 1.00 11.31 H new ATOM 0 HE2 PHE A 68 7.024 0.365 -23.840 1.00 62.22 H new ATOM 0 HZ PHE A 68 6.789 2.415 -22.497 1.00 24.21 H new ATOM 1122 N VAL A 69 5.574 -4.712 -17.990 1.00 10.42 N ATOM 1123 CA VAL A 69 5.284 -6.100 -17.652 1.00 64.13 C ATOM 1124 C VAL A 69 4.227 -6.191 -16.558 1.00 12.30 C ATOM 1125 O VAL A 69 4.105 -5.296 -15.720 1.00 63.22 O ATOM 1126 CB VAL A 69 6.552 -6.841 -17.188 1.00 64.11 C ATOM 1127 CG1 VAL A 69 6.273 -8.327 -17.024 1.00 72.21 C ATOM 1128 CG2 VAL A 69 7.693 -6.610 -18.168 1.00 11.32 C ATOM 0 H VAL A 69 5.474 -4.059 -17.213 1.00 10.42 H new ATOM 0 HA VAL A 69 4.906 -6.573 -18.558 1.00 64.13 H new ATOM 0 HB VAL A 69 6.850 -6.442 -16.218 1.00 64.11 H new ATOM 0 HG11 VAL A 69 7.181 -8.834 -16.696 1.00 72.21 H new ATOM 0 HG12 VAL A 69 5.489 -8.470 -16.281 1.00 72.21 H new ATOM 0 HG13 VAL A 69 5.950 -8.744 -17.978 1.00 72.21 H new ATOM 0 HG21 VAL A 69 8.581 -7.141 -17.824 1.00 11.32 H new ATOM 0 HG22 VAL A 69 7.407 -6.980 -19.153 1.00 11.32 H new ATOM 0 HG23 VAL A 69 7.909 -5.543 -18.230 1.00 11.32 H new ATOM 1138 N THR A 70 3.462 -7.278 -16.570 1.00 60.11 N ATOM 1139 CA THR A 70 2.414 -7.486 -15.579 1.00 74.24 C ATOM 1140 C THR A 70 1.910 -8.925 -15.605 1.00 45.12 C ATOM 1141 O THR A 70 0.823 -9.204 -16.111 1.00 23.13 O ATOM 1142 CB THR A 70 1.225 -6.534 -15.811 1.00 72.41 C ATOM 1143 OG1 THR A 70 0.122 -6.917 -14.982 1.00 1.04 O ATOM 1144 CG2 THR A 70 0.797 -6.549 -17.271 1.00 12.42 C ATOM 0 H THR A 70 3.549 -8.028 -17.256 1.00 60.11 H new ATOM 0 HA THR A 70 2.854 -7.276 -14.604 1.00 74.24 H new ATOM 0 HB THR A 70 1.541 -5.524 -15.551 1.00 72.41 H new ATOM 0 HG1 THR A 70 -0.184 -7.812 -15.237 1.00 1.04 H new ATOM 0 HG21 THR A 70 -0.044 -5.870 -17.411 1.00 12.42 H new ATOM 0 HG22 THR A 70 1.630 -6.230 -17.898 1.00 12.42 H new ATOM 0 HG23 THR A 70 0.498 -7.559 -17.552 1.00 12.42 H new ATOM 1152 N VAL A 71 2.708 -9.836 -15.056 1.00 50.22 N ATOM 1153 CA VAL A 71 2.342 -11.247 -15.015 1.00 3.43 C ATOM 1154 C VAL A 71 3.376 -12.060 -14.244 1.00 43.21 C ATOM 1155 O VAL A 71 4.468 -11.575 -13.949 1.00 3.53 O ATOM 1156 CB VAL A 71 2.198 -11.831 -16.432 1.00 65.15 C ATOM 1157 CG1 VAL A 71 3.561 -12.201 -16.999 1.00 0.34 C ATOM 1158 CG2 VAL A 71 1.272 -13.038 -16.419 1.00 43.34 C ATOM 0 H VAL A 71 3.612 -9.622 -14.634 1.00 50.22 H new ATOM 0 HA VAL A 71 1.381 -11.310 -14.505 1.00 3.43 H new ATOM 0 HB VAL A 71 1.757 -11.070 -17.076 1.00 65.15 H new ATOM 0 HG11 VAL A 71 3.439 -12.612 -18.001 1.00 0.34 H new ATOM 0 HG12 VAL A 71 4.189 -11.312 -17.046 1.00 0.34 H new ATOM 0 HG13 VAL A 71 4.033 -12.945 -16.357 1.00 0.34 H new ATOM 0 HG21 VAL A 71 1.182 -13.438 -17.429 1.00 43.34 H new ATOM 0 HG22 VAL A 71 1.682 -13.804 -15.761 1.00 43.34 H new ATOM 0 HG23 VAL A 71 0.288 -12.738 -16.058 1.00 43.34 H new ATOM 1168 N SER A 72 3.025 -13.300 -13.921 1.00 75.44 N ATOM 1169 CA SER A 72 3.921 -14.181 -13.182 1.00 31.23 C ATOM 1170 C SER A 72 4.673 -15.111 -14.129 1.00 42.42 C ATOM 1171 O SER A 72 4.067 -15.885 -14.868 1.00 61.04 O ATOM 1172 CB SER A 72 3.133 -15.004 -12.160 1.00 64.13 C ATOM 1173 OG SER A 72 1.892 -15.429 -12.696 1.00 10.22 O ATOM 0 H SER A 72 2.126 -13.718 -14.160 1.00 75.44 H new ATOM 0 HA SER A 72 4.648 -13.561 -12.657 1.00 31.23 H new ATOM 0 HB2 SER A 72 3.719 -15.872 -11.858 1.00 64.13 H new ATOM 0 HB3 SER A 72 2.961 -14.408 -11.264 1.00 64.13 H new ATOM 0 HG SER A 72 1.408 -15.954 -12.025 1.00 10.22 H new ATOM 1179 N GLY A 73 6.000 -15.027 -14.101 1.00 30.02 N ATOM 1180 CA GLY A 73 6.815 -15.865 -14.961 1.00 74.10 C ATOM 1181 C GLY A 73 7.588 -15.063 -15.989 1.00 11.34 C ATOM 1182 O GLY A 73 7.095 -14.808 -17.086 1.00 74.34 O ATOM 0 H GLY A 73 6.525 -14.393 -13.498 1.00 30.02 H new ATOM 0 HA2 GLY A 73 7.514 -16.436 -14.350 1.00 74.10 H new ATOM 0 HA3 GLY A 73 6.176 -16.585 -15.472 1.00 74.10 H new ATOM 1186 N ASN A 74 8.804 -14.662 -15.631 1.00 54.41 N ATOM 1187 CA ASN A 74 9.646 -13.881 -16.530 1.00 51.10 C ATOM 1188 C ASN A 74 11.017 -13.631 -15.910 1.00 65.14 C ATOM 1189 O ASN A 74 11.331 -12.529 -15.459 1.00 31.42 O ATOM 1190 CB ASN A 74 8.974 -12.547 -16.863 1.00 33.41 C ATOM 1191 CG ASN A 74 9.371 -12.025 -18.230 1.00 74.22 C ATOM 1192 OD1 ASN A 74 9.627 -12.800 -19.152 1.00 53.43 O ATOM 1193 ND2 ASN A 74 9.424 -10.705 -18.367 1.00 35.32 N ATOM 0 H ASN A 74 9.228 -14.865 -14.726 1.00 54.41 H new ATOM 0 HA ASN A 74 9.780 -14.452 -17.449 1.00 51.10 H new ATOM 0 HB2 ASN A 74 7.892 -12.669 -16.824 1.00 33.41 H new ATOM 0 HB3 ASN A 74 9.239 -11.810 -16.105 1.00 33.41 H new ATOM 0 HD21 ASN A 74 9.685 -10.295 -19.264 1.00 35.32 H new ATOM 0 HD22 ASN A 74 9.204 -10.101 -17.575 1.00 35.32 H new ATOM 1200 N PRO A 75 11.856 -14.678 -15.888 1.00 41.40 N ATOM 1201 CA PRO A 75 13.208 -14.597 -15.328 1.00 3.33 C ATOM 1202 C PRO A 75 14.140 -13.743 -16.182 1.00 33.51 C ATOM 1203 O PRO A 75 14.461 -14.101 -17.316 1.00 4.32 O ATOM 1204 CB PRO A 75 13.676 -16.054 -15.319 1.00 23.15 C ATOM 1205 CG PRO A 75 12.884 -16.713 -16.394 1.00 33.20 C ATOM 1206 CD PRO A 75 11.549 -16.020 -16.409 1.00 21.44 C ATOM 0 HA PRO A 75 13.214 -14.127 -14.345 1.00 3.33 H new ATOM 0 HB2 PRO A 75 14.746 -16.127 -15.514 1.00 23.15 H new ATOM 0 HB3 PRO A 75 13.496 -16.522 -14.351 1.00 23.15 H new ATOM 0 HG2 PRO A 75 13.383 -16.620 -17.359 1.00 33.20 H new ATOM 0 HG3 PRO A 75 12.768 -17.779 -16.196 1.00 33.20 H new ATOM 0 HD2 PRO A 75 11.131 -15.975 -17.415 1.00 21.44 H new ATOM 0 HD3 PRO A 75 10.821 -16.537 -15.784 1.00 21.44 H new ATOM 1214 N THR A 76 14.571 -12.613 -15.631 1.00 23.11 N ATOM 1215 CA THR A 76 15.465 -11.709 -16.342 1.00 43.45 C ATOM 1216 C THR A 76 16.287 -10.870 -15.370 1.00 61.12 C ATOM 1217 O THR A 76 16.402 -9.655 -15.528 1.00 75.22 O ATOM 1218 CB THR A 76 14.684 -10.769 -17.280 1.00 10.41 C ATOM 1219 OG1 THR A 76 13.512 -10.280 -16.618 1.00 72.31 O ATOM 1220 CG2 THR A 76 14.287 -11.488 -18.560 1.00 21.30 C ATOM 0 H THR A 76 14.315 -12.302 -14.694 1.00 23.11 H new ATOM 0 HA THR A 76 16.134 -12.330 -16.937 1.00 43.45 H new ATOM 0 HB THR A 76 15.331 -9.931 -17.539 1.00 10.41 H new ATOM 0 HG1 THR A 76 13.022 -9.682 -17.220 1.00 72.31 H new ATOM 0 HG21 THR A 76 13.737 -10.804 -19.206 1.00 21.30 H new ATOM 0 HG22 THR A 76 15.183 -11.833 -19.076 1.00 21.30 H new ATOM 0 HG23 THR A 76 13.656 -12.343 -18.316 1.00 21.30 H new ATOM 1228 N GLU A 77 16.858 -11.527 -14.365 1.00 72.02 N ATOM 1229 CA GLU A 77 17.669 -10.840 -13.367 1.00 63.04 C ATOM 1230 C GLU A 77 18.754 -9.999 -14.034 1.00 24.12 C ATOM 1231 O GLU A 77 19.144 -8.949 -13.523 1.00 10.13 O ATOM 1232 CB GLU A 77 18.307 -11.851 -12.412 1.00 71.12 C ATOM 1233 CG GLU A 77 19.095 -12.942 -13.118 1.00 4.52 C ATOM 1234 CD GLU A 77 20.591 -12.812 -12.903 1.00 50.35 C ATOM 1235 OE1 GLU A 77 21.079 -13.261 -11.846 1.00 22.45 O ATOM 1236 OE2 GLU A 77 21.273 -12.261 -13.793 1.00 13.33 O ATOM 0 H GLU A 77 16.774 -12.533 -14.221 1.00 72.02 H new ATOM 0 HA GLU A 77 17.016 -10.177 -12.799 1.00 63.04 H new ATOM 0 HB2 GLU A 77 18.969 -11.322 -11.726 1.00 71.12 H new ATOM 0 HB3 GLU A 77 17.525 -12.312 -11.809 1.00 71.12 H new ATOM 0 HG2 GLU A 77 18.763 -13.916 -12.758 1.00 4.52 H new ATOM 0 HG3 GLU A 77 18.881 -12.907 -14.186 1.00 4.52 H new ATOM 1243 N LYS A 78 19.239 -10.469 -15.178 1.00 42.22 N ATOM 1244 CA LYS A 78 20.279 -9.762 -15.917 1.00 13.21 C ATOM 1245 C LYS A 78 19.733 -8.474 -16.526 1.00 4.02 C ATOM 1246 O LYS A 78 20.419 -7.453 -16.555 1.00 51.44 O ATOM 1247 CB LYS A 78 20.849 -10.658 -17.019 1.00 3.34 C ATOM 1248 CG LYS A 78 21.933 -9.989 -17.847 1.00 13.44 C ATOM 1249 CD LYS A 78 21.706 -10.197 -19.335 1.00 21.25 C ATOM 1250 CE LYS A 78 22.109 -11.598 -19.769 1.00 33.24 C ATOM 1251 NZ LYS A 78 21.440 -12.000 -21.037 1.00 52.40 N ATOM 0 H LYS A 78 18.928 -11.337 -15.614 1.00 42.22 H new ATOM 0 HA LYS A 78 21.075 -9.504 -15.219 1.00 13.21 H new ATOM 0 HB2 LYS A 78 21.255 -11.562 -16.566 1.00 3.34 H new ATOM 0 HB3 LYS A 78 20.039 -10.968 -17.679 1.00 3.34 H new ATOM 0 HG2 LYS A 78 21.954 -8.922 -17.627 1.00 13.44 H new ATOM 0 HG3 LYS A 78 22.907 -10.391 -17.567 1.00 13.44 H new ATOM 0 HD2 LYS A 78 20.655 -10.030 -19.571 1.00 21.25 H new ATOM 0 HD3 LYS A 78 22.280 -9.461 -19.898 1.00 21.25 H new ATOM 0 HE2 LYS A 78 23.190 -11.641 -19.900 1.00 33.24 H new ATOM 0 HE3 LYS A 78 21.855 -12.309 -18.983 1.00 33.24 H new ATOM 0 HZ1 LYS A 78 21.741 -12.961 -21.299 1.00 52.40 H new ATOM 0 HZ2 LYS A 78 20.408 -11.984 -20.905 1.00 52.40 H new ATOM 0 HZ3 LYS A 78 21.703 -11.337 -21.794 1.00 52.40 H new ATOM 1265 N GLU A 79 18.496 -8.531 -17.009 1.00 2.42 N ATOM 1266 CA GLU A 79 17.860 -7.367 -17.616 1.00 60.51 C ATOM 1267 C GLU A 79 17.593 -6.287 -16.573 1.00 1.55 C ATOM 1268 O GLU A 79 17.813 -5.100 -16.819 1.00 65.34 O ATOM 1269 CB GLU A 79 16.549 -7.771 -18.295 1.00 24.44 C ATOM 1270 CG GLU A 79 16.023 -6.732 -19.270 1.00 3.11 C ATOM 1271 CD GLU A 79 16.568 -6.920 -20.673 1.00 14.13 C ATOM 1272 OE1 GLU A 79 17.801 -7.056 -20.817 1.00 12.43 O ATOM 1273 OE2 GLU A 79 15.761 -6.931 -21.626 1.00 63.10 O ATOM 0 H GLU A 79 17.915 -9.369 -16.992 1.00 2.42 H new ATOM 0 HA GLU A 79 18.540 -6.963 -18.366 1.00 60.51 H new ATOM 0 HB2 GLU A 79 16.699 -8.711 -18.825 1.00 24.44 H new ATOM 0 HB3 GLU A 79 15.795 -7.954 -17.530 1.00 24.44 H new ATOM 0 HG2 GLU A 79 14.935 -6.783 -19.297 1.00 3.11 H new ATOM 0 HG3 GLU A 79 16.287 -5.737 -18.912 1.00 3.11 H new ATOM 1280 N THR A 80 17.116 -6.705 -15.404 1.00 40.12 N ATOM 1281 CA THR A 80 16.817 -5.774 -14.323 1.00 71.23 C ATOM 1282 C THR A 80 18.006 -4.864 -14.037 1.00 13.02 C ATOM 1283 O THR A 80 17.854 -3.648 -13.924 1.00 23.12 O ATOM 1284 CB THR A 80 16.432 -6.519 -13.031 1.00 50.01 C ATOM 1285 OG1 THR A 80 17.584 -7.163 -12.475 1.00 11.41 O ATOM 1286 CG2 THR A 80 15.350 -7.552 -13.304 1.00 73.51 C ATOM 0 H THR A 80 16.929 -7.683 -15.182 1.00 40.12 H new ATOM 0 HA THR A 80 15.971 -5.170 -14.651 1.00 71.23 H new ATOM 0 HB THR A 80 16.045 -5.790 -12.319 1.00 50.01 H new ATOM 0 HG1 THR A 80 17.925 -7.828 -13.109 1.00 11.41 H new ATOM 0 HG21 THR A 80 15.095 -8.065 -12.377 1.00 73.51 H new ATOM 0 HG22 THR A 80 14.464 -7.055 -13.700 1.00 73.51 H new ATOM 0 HG23 THR A 80 15.715 -8.277 -14.032 1.00 73.51 H new ATOM 1294 N GLU A 81 19.188 -5.461 -13.921 1.00 51.21 N ATOM 1295 CA GLU A 81 20.403 -4.702 -13.648 1.00 15.24 C ATOM 1296 C GLU A 81 20.615 -3.617 -14.700 1.00 31.13 C ATOM 1297 O GLU A 81 20.887 -2.463 -14.370 1.00 23.53 O ATOM 1298 CB GLU A 81 21.615 -5.634 -13.608 1.00 62.14 C ATOM 1299 CG GLU A 81 22.803 -5.056 -12.858 1.00 64.04 C ATOM 1300 CD GLU A 81 23.936 -4.653 -13.782 1.00 43.41 C ATOM 1301 OE1 GLU A 81 23.758 -3.685 -14.551 1.00 52.30 O ATOM 1302 OE2 GLU A 81 25.000 -5.304 -13.737 1.00 24.24 O ATOM 0 H GLU A 81 19.330 -6.467 -14.012 1.00 51.21 H new ATOM 0 HA GLU A 81 20.291 -4.223 -12.675 1.00 15.24 H new ATOM 0 HB2 GLU A 81 21.324 -6.575 -13.141 1.00 62.14 H new ATOM 0 HB3 GLU A 81 21.918 -5.866 -14.629 1.00 62.14 H new ATOM 0 HG2 GLU A 81 22.479 -4.187 -12.286 1.00 64.04 H new ATOM 0 HG3 GLU A 81 23.168 -5.791 -12.141 1.00 64.04 H new ATOM 1309 N GLU A 82 20.488 -3.997 -15.967 1.00 64.53 N ATOM 1310 CA GLU A 82 20.668 -3.058 -17.068 1.00 11.34 C ATOM 1311 C GLU A 82 19.775 -1.833 -16.888 1.00 45.02 C ATOM 1312 O GLU A 82 20.116 -0.734 -17.328 1.00 72.31 O ATOM 1313 CB GLU A 82 20.358 -3.737 -18.403 1.00 41.23 C ATOM 1314 CG GLU A 82 21.050 -3.088 -19.591 1.00 35.23 C ATOM 1315 CD GLU A 82 20.900 -3.896 -20.866 1.00 14.45 C ATOM 1316 OE1 GLU A 82 21.165 -5.115 -20.831 1.00 33.22 O ATOM 1317 OE2 GLU A 82 20.517 -3.307 -21.898 1.00 54.23 O ATOM 0 H GLU A 82 20.261 -4.948 -16.257 1.00 64.53 H new ATOM 0 HA GLU A 82 21.708 -2.732 -17.068 1.00 11.34 H new ATOM 0 HB2 GLU A 82 20.657 -4.784 -18.347 1.00 41.23 H new ATOM 0 HB3 GLU A 82 19.281 -3.721 -18.568 1.00 41.23 H new ATOM 0 HG2 GLU A 82 20.638 -2.091 -19.747 1.00 35.23 H new ATOM 0 HG3 GLU A 82 22.109 -2.964 -19.366 1.00 35.23 H new ATOM 1324 N ILE A 83 18.633 -2.031 -16.240 1.00 54.10 N ATOM 1325 CA ILE A 83 17.692 -0.943 -16.002 1.00 33.51 C ATOM 1326 C ILE A 83 18.365 0.218 -15.278 1.00 62.34 C ATOM 1327 O ILE A 83 18.043 1.383 -15.515 1.00 32.44 O ATOM 1328 CB ILE A 83 16.482 -1.417 -15.175 1.00 11.23 C ATOM 1329 CG1 ILE A 83 15.850 -2.654 -15.817 1.00 10.44 C ATOM 1330 CG2 ILE A 83 15.458 -0.299 -15.046 1.00 3.41 C ATOM 1331 CD1 ILE A 83 15.417 -2.436 -17.250 1.00 20.24 C ATOM 0 H ILE A 83 18.336 -2.934 -15.870 1.00 54.10 H new ATOM 0 HA ILE A 83 17.345 -0.606 -16.979 1.00 33.51 H new ATOM 0 HB ILE A 83 16.826 -1.685 -14.176 1.00 11.23 H new ATOM 0 HG12 ILE A 83 16.565 -3.476 -15.783 1.00 10.44 H new ATOM 0 HG13 ILE A 83 14.986 -2.958 -15.227 1.00 10.44 H new ATOM 0 HG21 ILE A 83 14.609 -0.649 -14.459 1.00 3.41 H new ATOM 0 HG22 ILE A 83 15.914 0.557 -14.549 1.00 3.41 H new ATOM 0 HG23 ILE A 83 15.116 -0.003 -16.038 1.00 3.41 H new ATOM 0 HD11 ILE A 83 14.978 -3.354 -17.641 1.00 20.24 H new ATOM 0 HD12 ILE A 83 14.678 -1.635 -17.289 1.00 20.24 H new ATOM 0 HD13 ILE A 83 16.282 -2.162 -17.854 1.00 20.24 H new ATOM 1343 N THR A 84 19.305 -0.107 -14.396 1.00 32.23 N ATOM 1344 CA THR A 84 20.025 0.908 -13.638 1.00 20.04 C ATOM 1345 C THR A 84 20.741 1.882 -14.566 1.00 10.52 C ATOM 1346 O THR A 84 20.876 3.066 -14.254 1.00 63.42 O ATOM 1347 CB THR A 84 21.056 0.272 -12.685 1.00 54.35 C ATOM 1348 OG1 THR A 84 21.408 1.201 -11.655 1.00 4.44 O ATOM 1349 CG2 THR A 84 22.305 -0.150 -13.444 1.00 51.21 C ATOM 0 H THR A 84 19.585 -1.066 -14.189 1.00 32.23 H new ATOM 0 HA THR A 84 19.283 1.449 -13.050 1.00 20.04 H new ATOM 0 HB THR A 84 20.606 -0.614 -12.236 1.00 54.35 H new ATOM 0 HG1 THR A 84 21.489 0.727 -10.801 1.00 4.44 H new ATOM 0 HG21 THR A 84 23.018 -0.596 -12.751 1.00 51.21 H new ATOM 0 HG22 THR A 84 22.037 -0.879 -14.209 1.00 51.21 H new ATOM 0 HG23 THR A 84 22.756 0.723 -13.917 1.00 51.21 H new ATOM 1357 N SER A 85 21.197 1.378 -15.708 1.00 3.13 N ATOM 1358 CA SER A 85 21.903 2.204 -16.681 1.00 14.25 C ATOM 1359 C SER A 85 20.942 3.165 -17.375 1.00 63.01 C ATOM 1360 O SER A 85 21.100 4.384 -17.296 1.00 52.12 O ATOM 1361 CB SER A 85 22.600 1.323 -17.719 1.00 5.43 C ATOM 1362 OG SER A 85 23.933 1.752 -17.938 1.00 24.35 O ATOM 0 H SER A 85 21.090 0.401 -15.983 1.00 3.13 H new ATOM 0 HA SER A 85 22.654 2.789 -16.149 1.00 14.25 H new ATOM 0 HB2 SER A 85 22.599 0.287 -17.381 1.00 5.43 H new ATOM 0 HB3 SER A 85 22.046 1.353 -18.657 1.00 5.43 H new ATOM 0 HG SER A 85 24.358 1.172 -18.604 1.00 24.35 H new ATOM 1368 N LEU A 86 19.947 2.607 -18.056 1.00 1.43 N ATOM 1369 CA LEU A 86 18.960 3.413 -18.765 1.00 55.23 C ATOM 1370 C LEU A 86 18.192 4.310 -17.799 1.00 23.12 C ATOM 1371 O LEU A 86 17.632 5.331 -18.196 1.00 51.24 O ATOM 1372 CB LEU A 86 17.985 2.510 -19.524 1.00 3.32 C ATOM 1373 CG LEU A 86 17.487 1.277 -18.769 1.00 55.51 C ATOM 1374 CD1 LEU A 86 15.971 1.304 -18.645 1.00 50.33 C ATOM 1375 CD2 LEU A 86 17.944 0.004 -19.466 1.00 1.32 C ATOM 0 H LEU A 86 19.803 1.600 -18.132 1.00 1.43 H new ATOM 0 HA LEU A 86 19.489 4.046 -19.477 1.00 55.23 H new ATOM 0 HB2 LEU A 86 17.121 3.106 -19.816 1.00 3.32 H new ATOM 0 HB3 LEU A 86 18.468 2.178 -20.443 1.00 3.32 H new ATOM 0 HG LEU A 86 17.914 1.291 -17.766 1.00 55.51 H new ATOM 0 HD11 LEU A 86 15.634 0.419 -18.105 1.00 50.33 H new ATOM 0 HD12 LEU A 86 15.666 2.198 -18.102 1.00 50.33 H new ATOM 0 HD13 LEU A 86 15.525 1.314 -19.639 1.00 50.33 H new ATOM 0 HD21 LEU A 86 17.580 -0.863 -18.915 1.00 1.32 H new ATOM 0 HD22 LEU A 86 17.546 -0.018 -20.481 1.00 1.32 H new ATOM 0 HD23 LEU A 86 19.033 -0.020 -19.503 1.00 1.32 H new ATOM 1387 N TRP A 87 18.174 3.922 -16.529 1.00 14.02 N ATOM 1388 CA TRP A 87 17.477 4.692 -15.505 1.00 11.42 C ATOM 1389 C TRP A 87 17.968 6.136 -15.481 1.00 23.52 C ATOM 1390 O TRP A 87 17.170 7.072 -15.481 1.00 74.33 O ATOM 1391 CB TRP A 87 17.675 4.050 -14.131 1.00 4.10 C ATOM 1392 CG TRP A 87 17.469 5.004 -12.994 1.00 14.23 C ATOM 1393 CD1 TRP A 87 16.413 5.853 -12.817 1.00 63.24 C ATOM 1394 CD2 TRP A 87 18.341 5.208 -11.877 1.00 32.13 C ATOM 1395 NE1 TRP A 87 16.577 6.572 -11.658 1.00 71.10 N ATOM 1396 CE2 TRP A 87 17.751 6.194 -11.062 1.00 51.21 C ATOM 1397 CE3 TRP A 87 19.561 4.652 -11.484 1.00 62.22 C ATOM 1398 CZ2 TRP A 87 18.342 6.635 -9.881 1.00 60.20 C ATOM 1399 CZ3 TRP A 87 20.147 5.090 -10.312 1.00 12.51 C ATOM 1400 CH2 TRP A 87 19.537 6.073 -9.521 1.00 51.30 C ATOM 0 H TRP A 87 18.634 3.079 -16.184 1.00 14.02 H new ATOM 0 HA TRP A 87 16.414 4.693 -15.747 1.00 11.42 H new ATOM 0 HB2 TRP A 87 16.983 3.215 -14.025 1.00 4.10 H new ATOM 0 HB3 TRP A 87 18.682 3.638 -14.072 1.00 4.10 H new ATOM 0 HD1 TRP A 87 15.573 5.945 -13.489 1.00 63.24 H new ATOM 0 HE1 TRP A 87 15.929 7.274 -11.299 1.00 71.10 H new ATOM 0 HE3 TRP A 87 20.038 3.893 -12.086 1.00 62.22 H new ATOM 0 HZ2 TRP A 87 17.874 7.393 -9.271 1.00 60.20 H new ATOM 0 HZ3 TRP A 87 21.091 4.668 -10.000 1.00 12.51 H new ATOM 0 HH2 TRP A 87 20.019 6.393 -8.609 1.00 51.30 H new ATOM 1411 N GLN A 88 19.286 6.307 -15.460 1.00 41.20 N ATOM 1412 CA GLN A 88 19.882 7.638 -15.435 1.00 63.44 C ATOM 1413 C GLN A 88 19.317 8.508 -16.553 1.00 3.11 C ATOM 1414 O GLN A 88 19.150 9.716 -16.388 1.00 74.32 O ATOM 1415 CB GLN A 88 21.403 7.540 -15.568 1.00 1.52 C ATOM 1416 CG GLN A 88 22.135 7.598 -14.237 1.00 13.05 C ATOM 1417 CD GLN A 88 23.320 6.654 -14.181 1.00 13.25 C ATOM 1418 OE1 GLN A 88 24.468 7.086 -14.072 1.00 14.32 O ATOM 1419 NE2 GLN A 88 23.047 5.357 -14.254 1.00 64.45 N ATOM 0 H GLN A 88 19.961 5.542 -15.460 1.00 41.20 H new ATOM 0 HA GLN A 88 19.637 8.102 -14.480 1.00 63.44 H new ATOM 0 HB2 GLN A 88 21.656 6.607 -16.072 1.00 1.52 H new ATOM 0 HB3 GLN A 88 21.757 8.352 -16.204 1.00 1.52 H new ATOM 0 HG2 GLN A 88 22.479 8.617 -14.060 1.00 13.05 H new ATOM 0 HG3 GLN A 88 21.441 7.351 -13.434 1.00 13.05 H new ATOM 0 HE21 GLN A 88 22.081 5.044 -14.344 1.00 64.45 H new ATOM 0 HE22 GLN A 88 23.804 4.674 -14.220 1.00 64.45 H new ATOM 1428 N GLY A 89 19.026 7.886 -17.691 1.00 54.03 N ATOM 1429 CA GLY A 89 18.483 8.620 -18.820 1.00 30.24 C ATOM 1430 C GLY A 89 17.158 9.281 -18.498 1.00 14.32 C ATOM 1431 O GLY A 89 17.030 10.503 -18.578 1.00 62.04 O ATOM 0 H GLY A 89 19.156 6.887 -17.852 1.00 54.03 H new ATOM 0 HA2 GLY A 89 19.198 9.381 -19.133 1.00 30.24 H new ATOM 0 HA3 GLY A 89 18.351 7.940 -19.662 1.00 30.24 H new ATOM 1435 N SER A 90 16.167 8.473 -18.134 1.00 24.23 N ATOM 1436 CA SER A 90 14.843 8.987 -17.804 1.00 21.40 C ATOM 1437 C SER A 90 14.934 10.084 -16.748 1.00 35.44 C ATOM 1438 O SER A 90 14.105 10.994 -16.708 1.00 74.13 O ATOM 1439 CB SER A 90 13.944 7.854 -17.304 1.00 54.52 C ATOM 1440 OG SER A 90 13.071 8.309 -16.285 1.00 32.05 O ATOM 0 H SER A 90 16.256 7.460 -18.060 1.00 24.23 H new ATOM 0 HA SER A 90 14.409 9.413 -18.708 1.00 21.40 H new ATOM 0 HB2 SER A 90 13.362 7.454 -18.134 1.00 54.52 H new ATOM 0 HB3 SER A 90 14.559 7.038 -16.923 1.00 54.52 H new ATOM 0 HG SER A 90 12.142 8.151 -16.555 1.00 32.05 H new ATOM 1446 N LEU A 91 15.946 9.990 -15.892 1.00 52.54 N ATOM 1447 CA LEU A 91 16.146 10.974 -14.834 1.00 45.42 C ATOM 1448 C LEU A 91 16.333 12.371 -15.418 1.00 13.32 C ATOM 1449 O LEU A 91 15.749 13.341 -14.933 1.00 2.01 O ATOM 1450 CB LEU A 91 17.361 10.598 -13.985 1.00 5.14 C ATOM 1451 CG LEU A 91 17.302 11.003 -12.511 1.00 53.03 C ATOM 1452 CD1 LEU A 91 17.162 9.775 -11.625 1.00 63.23 C ATOM 1453 CD2 LEU A 91 18.538 11.802 -12.127 1.00 43.42 C ATOM 0 H LEU A 91 16.640 9.243 -15.910 1.00 52.54 H new ATOM 0 HA LEU A 91 15.257 10.979 -14.204 1.00 45.42 H new ATOM 0 HB2 LEU A 91 17.497 9.518 -14.039 1.00 5.14 H new ATOM 0 HB3 LEU A 91 18.245 11.053 -14.431 1.00 5.14 H new ATOM 0 HG LEU A 91 16.426 11.634 -12.363 1.00 53.03 H new ATOM 0 HD11 LEU A 91 17.122 10.083 -10.580 1.00 63.23 H new ATOM 0 HD12 LEU A 91 16.246 9.243 -11.882 1.00 63.23 H new ATOM 0 HD13 LEU A 91 18.018 9.117 -11.777 1.00 63.23 H new ATOM 0 HD21 LEU A 91 18.478 12.081 -11.075 1.00 43.42 H new ATOM 0 HD22 LEU A 91 19.429 11.196 -12.292 1.00 43.42 H new ATOM 0 HD23 LEU A 91 18.594 12.702 -12.739 1.00 43.42 H new ATOM 1465 N PHE A 92 17.148 12.466 -16.463 1.00 11.50 N ATOM 1466 CA PHE A 92 17.410 13.745 -17.114 1.00 62.31 C ATOM 1467 C PHE A 92 16.177 14.234 -17.868 1.00 63.14 C ATOM 1468 O PHE A 92 15.963 15.436 -18.016 1.00 5.43 O ATOM 1469 CB PHE A 92 18.593 13.618 -18.076 1.00 24.11 C ATOM 1470 CG PHE A 92 18.938 14.902 -18.775 1.00 22.13 C ATOM 1471 CD1 PHE A 92 18.249 15.295 -19.910 1.00 74.24 C ATOM 1472 CD2 PHE A 92 19.952 15.716 -18.296 1.00 63.11 C ATOM 1473 CE1 PHE A 92 18.563 16.476 -20.556 1.00 1.03 C ATOM 1474 CE2 PHE A 92 20.271 16.898 -18.937 1.00 12.32 C ATOM 1475 CZ PHE A 92 19.576 17.278 -20.069 1.00 3.23 C ATOM 0 H PHE A 92 17.638 11.673 -16.877 1.00 11.50 H new ATOM 0 HA PHE A 92 17.655 14.474 -16.342 1.00 62.31 H new ATOM 0 HB2 PHE A 92 19.465 13.269 -17.523 1.00 24.11 H new ATOM 0 HB3 PHE A 92 18.364 12.857 -18.822 1.00 24.11 H new ATOM 0 HD1 PHE A 92 17.456 14.671 -20.295 1.00 74.24 H new ATOM 0 HD2 PHE A 92 20.499 15.423 -17.412 1.00 63.11 H new ATOM 0 HE1 PHE A 92 18.017 16.771 -21.440 1.00 1.03 H new ATOM 0 HE2 PHE A 92 21.063 17.524 -18.553 1.00 12.32 H new ATOM 0 HZ PHE A 92 19.825 18.201 -20.572 1.00 3.23 H new ATOM 1485 N ASN A 93 15.370 13.292 -18.345 1.00 32.25 N ATOM 1486 CA ASN A 93 14.159 13.626 -19.085 1.00 35.11 C ATOM 1487 C ASN A 93 13.193 14.426 -18.216 1.00 31.33 C ATOM 1488 O ASN A 93 12.845 15.561 -18.539 1.00 62.13 O ATOM 1489 CB ASN A 93 13.475 12.352 -19.587 1.00 41.41 C ATOM 1490 CG ASN A 93 12.441 12.636 -20.659 1.00 74.31 C ATOM 1491 OD1 ASN A 93 12.643 12.319 -21.832 1.00 13.35 O ATOM 1492 ND2 ASN A 93 11.325 13.235 -20.261 1.00 12.45 N ATOM 0 H ASN A 93 15.533 12.291 -18.232 1.00 32.25 H new ATOM 0 HA ASN A 93 14.444 14.239 -19.940 1.00 35.11 H new ATOM 0 HB2 ASN A 93 14.228 11.671 -19.983 1.00 41.41 H new ATOM 0 HB3 ASN A 93 12.996 11.845 -18.749 1.00 41.41 H new ATOM 0 HD21 ASN A 93 10.593 13.450 -20.938 1.00 12.45 H new ATOM 0 HD22 ASN A 93 11.200 13.480 -19.279 1.00 12.45 H new ATOM 1499 N ALA A 94 12.764 13.825 -17.110 1.00 41.24 N ATOM 1500 CA ALA A 94 11.841 14.482 -16.193 1.00 62.11 C ATOM 1501 C ALA A 94 12.367 14.440 -14.762 1.00 52.52 C ATOM 1502 O ALA A 94 12.910 15.424 -14.262 1.00 43.31 O ATOM 1503 CB ALA A 94 10.467 13.833 -16.272 1.00 24.53 C ATOM 0 H ALA A 94 13.041 12.885 -16.828 1.00 41.24 H new ATOM 0 HA ALA A 94 11.754 15.527 -16.490 1.00 62.11 H new ATOM 0 HB1 ALA A 94 9.788 14.334 -15.582 1.00 24.53 H new ATOM 0 HB2 ALA A 94 10.081 13.920 -17.288 1.00 24.53 H new ATOM 0 HB3 ALA A 94 10.546 12.780 -16.003 1.00 24.53 H new ATOM 1509 N ASN A 95 12.200 13.295 -14.108 1.00 43.34 N ATOM 1510 CA ASN A 95 12.657 13.127 -12.734 1.00 22.42 C ATOM 1511 C ASN A 95 12.390 11.707 -12.242 1.00 15.52 C ATOM 1512 O ASN A 95 11.762 11.508 -11.201 1.00 64.12 O ATOM 1513 CB ASN A 95 11.964 14.136 -11.816 1.00 73.33 C ATOM 1514 CG ASN A 95 12.860 14.599 -10.684 1.00 42.34 C ATOM 1515 OD1 ASN A 95 12.677 14.207 -9.532 1.00 15.11 O ATOM 1516 ND2 ASN A 95 13.836 15.439 -11.009 1.00 25.21 N ATOM 0 H ASN A 95 11.752 12.470 -14.507 1.00 43.34 H new ATOM 0 HA ASN A 95 13.732 13.305 -12.711 1.00 22.42 H new ATOM 0 HB2 ASN A 95 11.648 14.999 -12.402 1.00 73.33 H new ATOM 0 HB3 ASN A 95 11.062 13.686 -11.401 1.00 73.33 H new ATOM 0 HD21 ASN A 95 14.471 15.786 -10.290 1.00 25.21 H new ATOM 0 HD22 ASN A 95 13.951 15.738 -11.978 1.00 25.21 H new ATOM 1523 N TYR A 96 12.869 10.725 -12.997 1.00 4.45 N ATOM 1524 CA TYR A 96 12.681 9.325 -12.639 1.00 33.52 C ATOM 1525 C TYR A 96 11.197 8.977 -12.560 1.00 2.51 C ATOM 1526 O TYR A 96 10.533 9.267 -11.565 1.00 34.53 O ATOM 1527 CB TYR A 96 13.359 9.022 -11.301 1.00 55.23 C ATOM 1528 CG TYR A 96 13.142 7.605 -10.819 1.00 41.45 C ATOM 1529 CD1 TYR A 96 13.530 6.520 -11.596 1.00 13.13 C ATOM 1530 CD2 TYR A 96 12.549 7.352 -9.589 1.00 3.02 C ATOM 1531 CE1 TYR A 96 13.333 5.224 -11.160 1.00 64.20 C ATOM 1532 CE2 TYR A 96 12.350 6.059 -9.144 1.00 45.24 C ATOM 1533 CZ TYR A 96 12.744 4.999 -9.934 1.00 31.44 C ATOM 1534 OH TYR A 96 12.546 3.709 -9.495 1.00 43.41 O ATOM 0 H TYR A 96 13.390 10.873 -13.861 1.00 4.45 H new ATOM 0 HA TYR A 96 13.139 8.714 -13.417 1.00 33.52 H new ATOM 0 HB2 TYR A 96 14.429 9.205 -11.396 1.00 55.23 H new ATOM 0 HB3 TYR A 96 12.983 9.715 -10.548 1.00 55.23 H new ATOM 0 HD1 TYR A 96 13.993 6.693 -12.556 1.00 13.13 H new ATOM 0 HD2 TYR A 96 12.238 8.180 -8.969 1.00 3.02 H new ATOM 0 HE1 TYR A 96 13.639 4.392 -11.776 1.00 64.20 H new ATOM 0 HE2 TYR A 96 11.889 5.879 -8.184 1.00 45.24 H new ATOM 0 HH TYR A 96 12.121 3.726 -8.612 1.00 43.41 H new ATOM 1544 N ASP A 97 10.685 8.355 -13.616 1.00 1.30 N ATOM 1545 CA ASP A 97 9.281 7.966 -13.667 1.00 54.25 C ATOM 1546 C ASP A 97 9.140 6.451 -13.775 1.00 21.02 C ATOM 1547 O ASP A 97 8.767 5.924 -14.823 1.00 42.22 O ATOM 1548 CB ASP A 97 8.586 8.640 -14.851 1.00 54.44 C ATOM 1549 CG ASP A 97 9.141 10.021 -15.139 1.00 43.22 C ATOM 1550 OD1 ASP A 97 8.630 11.000 -14.556 1.00 4.32 O ATOM 1551 OD2 ASP A 97 10.088 10.123 -15.947 1.00 72.23 O ATOM 0 H ASP A 97 11.221 8.109 -14.448 1.00 1.30 H new ATOM 0 HA ASP A 97 8.806 8.292 -12.742 1.00 54.25 H new ATOM 0 HB2 ASP A 97 8.697 8.015 -15.737 1.00 54.44 H new ATOM 0 HB3 ASP A 97 7.518 8.716 -14.646 1.00 54.44 H new ATOM 1556 N VAL A 98 9.442 5.755 -12.683 1.00 63.14 N ATOM 1557 CA VAL A 98 9.350 4.300 -12.654 1.00 52.14 C ATOM 1558 C VAL A 98 8.546 3.824 -11.450 1.00 11.44 C ATOM 1559 O VAL A 98 8.597 4.430 -10.379 1.00 64.43 O ATOM 1560 CB VAL A 98 10.745 3.650 -12.616 1.00 24.42 C ATOM 1561 CG1 VAL A 98 10.637 2.141 -12.781 1.00 15.53 C ATOM 1562 CG2 VAL A 98 11.642 4.248 -13.689 1.00 54.34 C ATOM 0 H VAL A 98 9.752 6.175 -11.807 1.00 63.14 H new ATOM 0 HA VAL A 98 8.841 3.997 -13.569 1.00 52.14 H new ATOM 0 HB VAL A 98 11.194 3.854 -11.644 1.00 24.42 H new ATOM 0 HG11 VAL A 98 11.633 1.700 -12.752 1.00 15.53 H new ATOM 0 HG12 VAL A 98 10.033 1.729 -11.972 1.00 15.53 H new ATOM 0 HG13 VAL A 98 10.167 1.912 -13.737 1.00 15.53 H new ATOM 0 HG21 VAL A 98 12.624 3.776 -13.647 1.00 54.34 H new ATOM 0 HG22 VAL A 98 11.199 4.077 -14.670 1.00 54.34 H new ATOM 0 HG23 VAL A 98 11.747 5.320 -13.520 1.00 54.34 H new ATOM 1572 N GLN A 99 7.804 2.737 -11.632 1.00 63.40 N ATOM 1573 CA GLN A 99 6.989 2.180 -10.559 1.00 60.31 C ATOM 1574 C GLN A 99 7.259 0.688 -10.389 1.00 14.35 C ATOM 1575 O GLN A 99 7.513 -0.022 -11.362 1.00 10.43 O ATOM 1576 CB GLN A 99 5.504 2.412 -10.845 1.00 4.32 C ATOM 1577 CG GLN A 99 5.215 3.747 -11.512 1.00 1.30 C ATOM 1578 CD GLN A 99 5.843 4.915 -10.777 1.00 13.21 C ATOM 1579 OE1 GLN A 99 5.812 4.979 -9.548 1.00 22.44 O ATOM 1580 NE2 GLN A 99 6.417 5.848 -11.528 1.00 33.03 N ATOM 0 H GLN A 99 7.750 2.224 -12.512 1.00 63.40 H new ATOM 0 HA GLN A 99 7.257 2.687 -9.632 1.00 60.31 H new ATOM 0 HB2 GLN A 99 5.136 1.609 -11.483 1.00 4.32 H new ATOM 0 HB3 GLN A 99 4.949 2.355 -9.909 1.00 4.32 H new ATOM 0 HG2 GLN A 99 5.587 3.725 -12.536 1.00 1.30 H new ATOM 0 HG3 GLN A 99 4.137 3.895 -11.568 1.00 1.30 H new ATOM 0 HE21 GLN A 99 6.420 5.755 -12.544 1.00 33.03 H new ATOM 0 HE22 GLN A 99 6.855 6.658 -11.089 1.00 33.03 H new ATOM 1589 N ARG A 100 7.201 0.220 -9.146 1.00 45.01 N ATOM 1590 CA ARG A 100 7.441 -1.187 -8.848 1.00 41.12 C ATOM 1591 C ARG A 100 6.320 -1.758 -7.985 1.00 22.41 C ATOM 1592 O ARG A 100 6.065 -1.276 -6.881 1.00 55.25 O ATOM 1593 CB ARG A 100 8.785 -1.358 -8.137 1.00 13.10 C ATOM 1594 CG ARG A 100 9.230 -2.806 -8.016 1.00 35.24 C ATOM 1595 CD ARG A 100 10.073 -3.027 -6.770 1.00 23.21 C ATOM 1596 NE ARG A 100 9.267 -3.010 -5.552 1.00 50.24 N ATOM 1597 CZ ARG A 100 9.777 -3.121 -4.331 1.00 65.42 C ATOM 1598 NH1 ARG A 100 11.086 -3.257 -4.166 1.00 30.31 N ATOM 1599 NH2 ARG A 100 8.979 -3.097 -3.272 1.00 14.30 N ATOM 0 H ARG A 100 6.990 0.794 -8.330 1.00 45.01 H new ATOM 0 HA ARG A 100 7.465 -1.734 -9.791 1.00 41.12 H new ATOM 0 HB2 ARG A 100 9.547 -0.797 -8.678 1.00 13.10 H new ATOM 0 HB3 ARG A 100 8.717 -0.923 -7.140 1.00 13.10 H new ATOM 0 HG2 ARG A 100 8.355 -3.455 -7.985 1.00 35.24 H new ATOM 0 HG3 ARG A 100 9.804 -3.087 -8.899 1.00 35.24 H new ATOM 0 HD2 ARG A 100 10.591 -3.983 -6.848 1.00 23.21 H new ATOM 0 HD3 ARG A 100 10.838 -2.253 -6.709 1.00 23.21 H new ATOM 0 HE ARG A 100 8.256 -2.907 -5.644 1.00 50.24 H new ATOM 0 HH11 ARG A 100 11.703 -3.276 -4.978 1.00 30.31 H new ATOM 0 HH12 ARG A 100 11.476 -3.342 -3.227 1.00 30.31 H new ATOM 0 HH21 ARG A 100 7.972 -2.993 -3.395 1.00 14.30 H new ATOM 0 HH22 ARG A 100 9.373 -3.182 -2.335 1.00 14.30 H new ATOM 1613 N PHE A 101 5.654 -2.789 -8.495 1.00 41.13 N ATOM 1614 CA PHE A 101 4.559 -3.425 -7.772 1.00 65.41 C ATOM 1615 C PHE A 101 4.713 -4.944 -7.780 1.00 15.40 C ATOM 1616 O PHE A 101 4.789 -5.565 -8.841 1.00 5.45 O ATOM 1617 CB PHE A 101 3.216 -3.034 -8.390 1.00 53.23 C ATOM 1618 CG PHE A 101 2.031 -3.510 -7.600 1.00 73.41 C ATOM 1619 CD1 PHE A 101 1.888 -3.168 -6.265 1.00 43.31 C ATOM 1620 CD2 PHE A 101 1.059 -4.301 -8.192 1.00 52.43 C ATOM 1621 CE1 PHE A 101 0.799 -3.606 -5.536 1.00 2.33 C ATOM 1622 CE2 PHE A 101 -0.033 -4.741 -7.468 1.00 22.30 C ATOM 1623 CZ PHE A 101 -0.163 -4.392 -6.138 1.00 72.41 C ATOM 0 H PHE A 101 5.854 -3.202 -9.406 1.00 41.13 H new ATOM 0 HA PHE A 101 4.589 -3.079 -6.739 1.00 65.41 H new ATOM 0 HB2 PHE A 101 3.169 -1.949 -8.481 1.00 53.23 H new ATOM 0 HB3 PHE A 101 3.157 -3.442 -9.399 1.00 53.23 H new ATOM 0 HD1 PHE A 101 2.636 -2.552 -5.789 1.00 43.31 H new ATOM 0 HD2 PHE A 101 1.156 -4.577 -9.232 1.00 52.43 H new ATOM 0 HE1 PHE A 101 0.700 -3.334 -4.496 1.00 2.33 H new ATOM 0 HE2 PHE A 101 -0.783 -5.357 -7.941 1.00 22.30 H new ATOM 0 HZ PHE A 101 -1.016 -4.733 -5.570 1.00 72.41 H new ATOM 1633 N ILE A 102 4.756 -5.534 -6.590 1.00 45.14 N ATOM 1634 CA ILE A 102 4.900 -6.979 -6.460 1.00 12.40 C ATOM 1635 C ILE A 102 3.847 -7.553 -5.518 1.00 11.41 C ATOM 1636 O ILE A 102 3.782 -7.186 -4.344 1.00 63.34 O ATOM 1637 CB ILE A 102 6.299 -7.361 -5.942 1.00 71.02 C ATOM 1638 CG1 ILE A 102 7.380 -6.628 -6.739 1.00 54.14 C ATOM 1639 CG2 ILE A 102 6.501 -8.867 -6.025 1.00 42.45 C ATOM 1640 CD1 ILE A 102 8.784 -6.900 -6.246 1.00 75.45 C ATOM 0 H ILE A 102 4.693 -5.034 -5.703 1.00 45.14 H new ATOM 0 HA ILE A 102 4.763 -7.401 -7.456 1.00 12.40 H new ATOM 0 HB ILE A 102 6.378 -7.060 -4.897 1.00 71.02 H new ATOM 0 HG12 ILE A 102 7.309 -6.920 -7.787 1.00 54.14 H new ATOM 0 HG13 ILE A 102 7.189 -5.556 -6.694 1.00 54.14 H new ATOM 0 HG21 ILE A 102 7.494 -9.122 -5.655 1.00 42.45 H new ATOM 0 HG22 ILE A 102 5.748 -9.369 -5.418 1.00 42.45 H new ATOM 0 HG23 ILE A 102 6.406 -9.190 -7.062 1.00 42.45 H new ATOM 0 HD11 ILE A 102 9.498 -6.348 -6.857 1.00 75.45 H new ATOM 0 HD12 ILE A 102 8.873 -6.581 -5.207 1.00 75.45 H new ATOM 0 HD13 ILE A 102 8.994 -7.967 -6.317 1.00 75.45 H new ATOM 1652 N VAL A 103 3.024 -8.457 -6.040 1.00 12.34 N ATOM 1653 CA VAL A 103 1.975 -9.085 -5.245 1.00 1.42 C ATOM 1654 C VAL A 103 1.788 -10.546 -5.638 1.00 1.34 C ATOM 1655 O VAL A 103 1.474 -10.855 -6.786 1.00 62.41 O ATOM 1656 CB VAL A 103 0.633 -8.346 -5.403 1.00 33.10 C ATOM 1657 CG1 VAL A 103 0.251 -8.240 -6.872 1.00 21.34 C ATOM 1658 CG2 VAL A 103 -0.458 -9.049 -4.609 1.00 53.14 C ATOM 0 H VAL A 103 3.063 -8.771 -7.010 1.00 12.34 H new ATOM 0 HA VAL A 103 2.291 -9.030 -4.203 1.00 1.42 H new ATOM 0 HB VAL A 103 0.745 -7.336 -5.008 1.00 33.10 H new ATOM 0 HG11 VAL A 103 -0.700 -7.715 -6.964 1.00 21.34 H new ATOM 0 HG12 VAL A 103 1.023 -7.690 -7.410 1.00 21.34 H new ATOM 0 HG13 VAL A 103 0.156 -9.240 -7.296 1.00 21.34 H new ATOM 0 HG21 VAL A 103 -1.400 -8.514 -4.732 1.00 53.14 H new ATOM 0 HG22 VAL A 103 -0.571 -10.071 -4.972 1.00 53.14 H new ATOM 0 HG23 VAL A 103 -0.186 -9.067 -3.554 1.00 53.14 H new ATOM 1668 N GLY A 104 1.983 -11.442 -4.675 1.00 1.45 N ATOM 1669 CA GLY A 104 1.831 -12.860 -4.939 1.00 62.33 C ATOM 1670 C GLY A 104 3.011 -13.438 -5.696 1.00 35.40 C ATOM 1671 O GLY A 104 4.151 -13.351 -5.242 1.00 3.20 O ATOM 0 H GLY A 104 2.244 -11.210 -3.716 1.00 1.45 H new ATOM 0 HA2 GLY A 104 1.713 -13.392 -3.995 1.00 62.33 H new ATOM 0 HA3 GLY A 104 0.919 -13.024 -5.513 1.00 62.33 H new ATOM 1675 N SER A 105 2.736 -14.033 -6.853 1.00 13.33 N ATOM 1676 CA SER A 105 3.782 -14.633 -7.672 1.00 5.25 C ATOM 1677 C SER A 105 3.946 -13.875 -8.986 1.00 33.14 C ATOM 1678 O SER A 105 4.725 -14.273 -9.852 1.00 32.22 O ATOM 1679 CB SER A 105 3.460 -16.102 -7.953 1.00 50.42 C ATOM 1680 OG SER A 105 4.274 -16.961 -7.174 1.00 13.13 O ATOM 0 H SER A 105 1.797 -14.112 -7.244 1.00 13.33 H new ATOM 0 HA SER A 105 4.720 -14.574 -7.120 1.00 5.25 H new ATOM 0 HB2 SER A 105 2.410 -16.295 -7.735 1.00 50.42 H new ATOM 0 HB3 SER A 105 3.611 -16.314 -9.011 1.00 50.42 H new ATOM 0 HG SER A 105 4.788 -17.550 -7.765 1.00 13.13 H new ATOM 1686 N ASP A 106 3.205 -12.781 -9.126 1.00 61.32 N ATOM 1687 CA ASP A 106 3.267 -11.966 -10.334 1.00 2.13 C ATOM 1688 C ASP A 106 3.612 -10.519 -9.995 1.00 54.20 C ATOM 1689 O ASP A 106 3.029 -9.928 -9.085 1.00 61.43 O ATOM 1690 CB ASP A 106 1.935 -12.024 -11.083 1.00 63.22 C ATOM 1691 CG ASP A 106 0.914 -11.053 -10.525 1.00 33.23 C ATOM 1692 OD1 ASP A 106 0.272 -11.388 -9.507 1.00 42.21 O ATOM 1693 OD2 ASP A 106 0.755 -9.959 -11.106 1.00 10.03 O ATOM 0 H ASP A 106 2.555 -12.438 -8.419 1.00 61.32 H new ATOM 0 HA ASP A 106 4.052 -12.368 -10.974 1.00 2.13 H new ATOM 0 HB2 ASP A 106 2.104 -11.803 -12.137 1.00 63.22 H new ATOM 0 HB3 ASP A 106 1.536 -13.037 -11.030 1.00 63.22 H new ATOM 1698 N ARG A 107 4.562 -9.954 -10.732 1.00 63.13 N ATOM 1699 CA ARG A 107 4.986 -8.577 -10.509 1.00 31.25 C ATOM 1700 C ARG A 107 4.875 -7.759 -11.792 1.00 13.24 C ATOM 1701 O ARG A 107 5.001 -8.293 -12.893 1.00 52.00 O ATOM 1702 CB ARG A 107 6.425 -8.542 -9.991 1.00 41.53 C ATOM 1703 CG ARG A 107 7.469 -8.731 -11.080 1.00 55.33 C ATOM 1704 CD ARG A 107 8.148 -7.417 -11.435 1.00 73.33 C ATOM 1705 NE ARG A 107 9.345 -7.622 -12.246 1.00 51.14 N ATOM 1706 CZ ARG A 107 9.314 -7.908 -13.543 1.00 71.41 C ATOM 1707 NH1 ARG A 107 8.153 -8.023 -14.173 1.00 14.15 N ATOM 1708 NH2 ARG A 107 10.446 -8.080 -14.213 1.00 62.31 N ATOM 0 H ARG A 107 5.053 -10.429 -11.489 1.00 63.13 H new ATOM 0 HA ARG A 107 4.327 -8.137 -9.761 1.00 31.25 H new ATOM 0 HB2 ARG A 107 6.600 -7.588 -9.493 1.00 41.53 H new ATOM 0 HB3 ARG A 107 6.551 -9.321 -9.240 1.00 41.53 H new ATOM 0 HG2 ARG A 107 8.217 -9.450 -10.747 1.00 55.33 H new ATOM 0 HG3 ARG A 107 6.997 -9.150 -11.969 1.00 55.33 H new ATOM 0 HD2 ARG A 107 7.447 -6.782 -11.977 1.00 73.33 H new ATOM 0 HD3 ARG A 107 8.416 -6.888 -10.520 1.00 73.33 H new ATOM 0 HE ARG A 107 10.255 -7.541 -11.792 1.00 51.14 H new ATOM 0 HH11 ARG A 107 7.280 -7.892 -13.662 1.00 14.15 H new ATOM 0 HH12 ARG A 107 8.133 -8.243 -15.169 1.00 14.15 H new ATOM 0 HH21 ARG A 107 11.341 -7.993 -13.732 1.00 62.31 H new ATOM 0 HH22 ARG A 107 10.421 -8.300 -15.209 1.00 62.31 H new ATOM 1722 N ALA A 108 4.637 -6.460 -11.640 1.00 43.03 N ATOM 1723 CA ALA A 108 4.511 -5.568 -12.786 1.00 53.01 C ATOM 1724 C ALA A 108 5.573 -4.475 -12.751 1.00 4.10 C ATOM 1725 O ALA A 108 5.956 -4.003 -11.680 1.00 50.51 O ATOM 1726 CB ALA A 108 3.119 -4.953 -12.825 1.00 25.10 C ATOM 0 H ALA A 108 4.528 -6.002 -10.735 1.00 43.03 H new ATOM 0 HA ALA A 108 4.663 -6.156 -13.691 1.00 53.01 H new ATOM 0 HB1 ALA A 108 3.039 -4.289 -13.686 1.00 25.10 H new ATOM 0 HB2 ALA A 108 2.374 -5.744 -12.906 1.00 25.10 H new ATOM 0 HB3 ALA A 108 2.947 -4.385 -11.911 1.00 25.10 H new ATOM 1732 N ILE A 109 6.047 -4.078 -13.928 1.00 35.35 N ATOM 1733 CA ILE A 109 7.065 -3.041 -14.030 1.00 50.43 C ATOM 1734 C ILE A 109 6.656 -1.966 -15.032 1.00 13.13 C ATOM 1735 O ILE A 109 6.044 -2.260 -16.059 1.00 64.02 O ATOM 1736 CB ILE A 109 8.426 -3.627 -14.451 1.00 14.22 C ATOM 1737 CG1 ILE A 109 9.476 -2.518 -14.545 1.00 71.25 C ATOM 1738 CG2 ILE A 109 8.299 -4.359 -15.778 1.00 63.04 C ATOM 1739 CD1 ILE A 109 10.881 -3.034 -14.763 1.00 22.12 C ATOM 0 H ILE A 109 5.742 -4.459 -14.823 1.00 35.35 H new ATOM 0 HA ILE A 109 7.161 -2.595 -13.040 1.00 50.43 H new ATOM 0 HB ILE A 109 8.748 -4.342 -13.694 1.00 14.22 H new ATOM 0 HG12 ILE A 109 9.213 -1.848 -15.363 1.00 71.25 H new ATOM 0 HG13 ILE A 109 9.452 -1.928 -13.629 1.00 71.25 H new ATOM 0 HG21 ILE A 109 9.269 -4.768 -16.062 1.00 63.04 H new ATOM 0 HG22 ILE A 109 7.578 -5.171 -15.678 1.00 63.04 H new ATOM 0 HG23 ILE A 109 7.959 -3.664 -16.546 1.00 63.04 H new ATOM 0 HD11 ILE A 109 11.573 -2.193 -14.820 1.00 22.12 H new ATOM 0 HD12 ILE A 109 11.164 -3.681 -13.933 1.00 22.12 H new ATOM 0 HD13 ILE A 109 10.920 -3.600 -15.694 1.00 22.12 H new ATOM 1751 N PHE A 110 6.998 -0.719 -14.726 1.00 44.12 N ATOM 1752 CA PHE A 110 6.668 0.401 -15.600 1.00 34.21 C ATOM 1753 C PHE A 110 7.708 1.511 -15.479 1.00 73.31 C ATOM 1754 O PHE A 110 7.914 2.068 -14.401 1.00 61.43 O ATOM 1755 CB PHE A 110 5.280 0.948 -15.260 1.00 33.21 C ATOM 1756 CG PHE A 110 4.945 2.223 -15.979 1.00 42.13 C ATOM 1757 CD1 PHE A 110 5.292 3.451 -15.438 1.00 61.35 C ATOM 1758 CD2 PHE A 110 4.283 2.194 -17.196 1.00 43.43 C ATOM 1759 CE1 PHE A 110 4.986 4.626 -16.098 1.00 41.21 C ATOM 1760 CE2 PHE A 110 3.975 3.366 -17.861 1.00 1.44 C ATOM 1761 CZ PHE A 110 4.326 4.584 -17.310 1.00 72.14 C ATOM 0 H PHE A 110 7.504 -0.458 -13.879 1.00 44.12 H new ATOM 0 HA PHE A 110 6.667 0.039 -16.628 1.00 34.21 H new ATOM 0 HB2 PHE A 110 4.531 0.195 -15.505 1.00 33.21 H new ATOM 0 HB3 PHE A 110 5.219 1.120 -14.185 1.00 33.21 H new ATOM 0 HD1 PHE A 110 5.807 3.490 -14.490 1.00 61.35 H new ATOM 0 HD2 PHE A 110 4.005 1.245 -17.630 1.00 43.43 H new ATOM 0 HE1 PHE A 110 5.263 5.576 -15.666 1.00 41.21 H new ATOM 0 HE2 PHE A 110 3.461 3.330 -18.810 1.00 1.44 H new ATOM 0 HZ PHE A 110 4.084 5.501 -17.827 1.00 72.14 H new ATOM 1771 N MET A 111 8.360 1.826 -16.593 1.00 60.12 N ATOM 1772 CA MET A 111 9.378 2.870 -16.613 1.00 25.52 C ATOM 1773 C MET A 111 9.312 3.670 -17.910 1.00 31.14 C ATOM 1774 O MET A 111 9.237 3.100 -18.999 1.00 52.53 O ATOM 1775 CB MET A 111 10.771 2.256 -16.449 1.00 54.50 C ATOM 1776 CG MET A 111 11.177 1.355 -17.603 1.00 61.23 C ATOM 1777 SD MET A 111 12.732 0.494 -17.298 1.00 51.31 S ATOM 1778 CE MET A 111 12.339 -0.390 -15.791 1.00 61.41 C ATOM 0 H MET A 111 8.202 1.374 -17.493 1.00 60.12 H new ATOM 0 HA MET A 111 9.186 3.546 -15.780 1.00 25.52 H new ATOM 0 HB2 MET A 111 11.503 3.057 -16.350 1.00 54.50 H new ATOM 0 HB3 MET A 111 10.799 1.682 -15.523 1.00 54.50 H new ATOM 0 HG2 MET A 111 10.390 0.623 -17.782 1.00 61.23 H new ATOM 0 HG3 MET A 111 11.269 1.952 -18.510 1.00 61.23 H new ATOM 0 HE1 MET A 111 12.925 -1.308 -15.744 1.00 61.41 H new ATOM 0 HE2 MET A 111 12.576 0.235 -14.930 1.00 61.41 H new ATOM 0 HE3 MET A 111 11.277 -0.636 -15.780 1.00 61.41 H new ATOM 1788 N LEU A 112 9.339 4.992 -17.785 1.00 45.25 N ATOM 1789 CA LEU A 112 9.282 5.871 -18.948 1.00 40.23 C ATOM 1790 C LEU A 112 10.026 7.176 -18.682 1.00 60.10 C ATOM 1791 O LEU A 112 10.052 7.668 -17.554 1.00 25.33 O ATOM 1792 CB LEU A 112 7.827 6.167 -19.318 1.00 23.44 C ATOM 1793 CG LEU A 112 7.438 5.905 -20.773 1.00 33.22 C ATOM 1794 CD1 LEU A 112 8.207 6.827 -21.706 1.00 1.24 C ATOM 1795 CD2 LEU A 112 7.685 4.448 -21.137 1.00 55.12 C ATOM 0 H LEU A 112 9.400 5.479 -16.891 1.00 45.25 H new ATOM 0 HA LEU A 112 9.766 5.361 -19.781 1.00 40.23 H new ATOM 0 HB2 LEU A 112 7.181 5.568 -18.677 1.00 23.44 H new ATOM 0 HB3 LEU A 112 7.621 7.213 -19.090 1.00 23.44 H new ATOM 0 HG LEU A 112 6.374 6.112 -20.887 1.00 33.22 H new ATOM 0 HD11 LEU A 112 7.917 6.626 -22.737 1.00 1.24 H new ATOM 0 HD12 LEU A 112 7.980 7.865 -21.461 1.00 1.24 H new ATOM 0 HD13 LEU A 112 9.277 6.653 -21.590 1.00 1.24 H new ATOM 0 HD21 LEU A 112 7.402 4.280 -22.176 1.00 55.12 H new ATOM 0 HD22 LEU A 112 8.742 4.214 -21.006 1.00 55.12 H new ATOM 0 HD23 LEU A 112 7.088 3.805 -20.490 1.00 55.12 H new ATOM 1807 N ARG A 113 10.627 7.732 -19.728 1.00 44.34 N ATOM 1808 CA ARG A 113 11.371 8.981 -19.608 1.00 31.53 C ATOM 1809 C ARG A 113 10.437 10.139 -19.270 1.00 0.10 C ATOM 1810 O ARG A 113 10.837 11.102 -18.615 1.00 64.32 O ATOM 1811 CB ARG A 113 12.122 9.279 -20.906 1.00 42.14 C ATOM 1812 CG ARG A 113 11.209 9.520 -22.097 1.00 14.20 C ATOM 1813 CD ARG A 113 11.608 8.663 -23.288 1.00 50.41 C ATOM 1814 NE ARG A 113 10.930 9.079 -24.513 1.00 42.22 N ATOM 1815 CZ ARG A 113 11.026 8.424 -25.665 1.00 32.14 C ATOM 1816 NH1 ARG A 113 11.767 7.328 -25.748 1.00 32.53 N ATOM 1817 NH2 ARG A 113 10.379 8.865 -26.736 1.00 71.30 N ATOM 0 H ARG A 113 10.614 7.338 -20.669 1.00 44.34 H new ATOM 0 HA ARG A 113 12.091 8.869 -18.798 1.00 31.53 H new ATOM 0 HB2 ARG A 113 12.751 10.157 -20.758 1.00 42.14 H new ATOM 0 HB3 ARG A 113 12.786 8.445 -21.131 1.00 42.14 H new ATOM 0 HG2 ARG A 113 10.179 9.299 -21.818 1.00 14.20 H new ATOM 0 HG3 ARG A 113 11.245 10.573 -22.377 1.00 14.20 H new ATOM 0 HD2 ARG A 113 12.687 8.723 -23.432 1.00 50.41 H new ATOM 0 HD3 ARG A 113 11.372 7.620 -23.079 1.00 50.41 H new ATOM 0 HE ARG A 113 10.351 9.918 -24.482 1.00 42.22 H new ATOM 0 HH11 ARG A 113 12.265 6.986 -24.926 1.00 32.53 H new ATOM 0 HH12 ARG A 113 11.839 6.827 -26.634 1.00 32.53 H new ATOM 0 HH21 ARG A 113 9.807 9.708 -26.675 1.00 71.30 H new ATOM 0 HH22 ARG A 113 10.453 8.362 -27.620 1.00 71.30 H new ATOM 1831 N ASP A 114 9.192 10.039 -19.722 1.00 13.14 N ATOM 1832 CA ASP A 114 8.200 11.078 -19.467 1.00 64.01 C ATOM 1833 C ASP A 114 7.615 10.939 -18.065 1.00 72.43 C ATOM 1834 O ASP A 114 7.942 11.711 -17.165 1.00 53.24 O ATOM 1835 CB ASP A 114 7.083 11.012 -20.509 1.00 53.40 C ATOM 1836 CG ASP A 114 7.423 11.778 -21.772 1.00 42.24 C ATOM 1837 OD1 ASP A 114 8.620 11.843 -22.123 1.00 4.23 O ATOM 1838 OD2 ASP A 114 6.493 12.312 -22.411 1.00 74.33 O ATOM 0 H ASP A 114 8.845 9.249 -20.267 1.00 13.14 H new ATOM 0 HA ASP A 114 8.696 12.046 -19.539 1.00 64.01 H new ATOM 0 HB2 ASP A 114 6.887 9.970 -20.761 1.00 53.40 H new ATOM 0 HB3 ASP A 114 6.165 11.414 -20.080 1.00 53.40 H new ATOM 1843 N GLY A 115 6.746 9.948 -17.888 1.00 71.10 N ATOM 1844 CA GLY A 115 6.128 9.726 -16.594 1.00 55.20 C ATOM 1845 C GLY A 115 4.734 10.316 -16.509 1.00 10.44 C ATOM 1846 O GLY A 115 3.769 9.608 -16.219 1.00 43.45 O ATOM 0 H GLY A 115 6.459 9.295 -18.618 1.00 71.10 H new ATOM 0 HA2 GLY A 115 6.079 8.655 -16.397 1.00 55.20 H new ATOM 0 HA3 GLY A 115 6.753 10.165 -15.816 1.00 55.20 H new ATOM 1850 N SER A 116 4.628 11.617 -16.759 1.00 55.42 N ATOM 1851 CA SER A 116 3.342 12.304 -16.704 1.00 22.13 C ATOM 1852 C SER A 116 2.392 11.764 -17.768 1.00 34.01 C ATOM 1853 O SER A 116 1.317 11.251 -17.454 1.00 25.51 O ATOM 1854 CB SER A 116 3.536 13.810 -16.893 1.00 72.42 C ATOM 1855 OG SER A 116 2.944 14.538 -15.831 1.00 23.50 O ATOM 0 H SER A 116 5.417 12.217 -17.002 1.00 55.42 H new ATOM 0 HA SER A 116 2.902 12.122 -15.723 1.00 22.13 H new ATOM 0 HB2 SER A 116 4.600 14.039 -16.946 1.00 72.42 H new ATOM 0 HB3 SER A 116 3.096 14.120 -17.841 1.00 72.42 H new ATOM 0 HG SER A 116 3.083 15.497 -15.974 1.00 23.50 H new ATOM 1861 N TYR A 117 2.795 11.884 -19.028 1.00 31.02 N ATOM 1862 CA TYR A 117 1.979 11.411 -20.140 1.00 20.22 C ATOM 1863 C TYR A 117 1.937 9.886 -20.175 1.00 2.14 C ATOM 1864 O TYR A 117 0.932 9.290 -20.559 1.00 55.34 O ATOM 1865 CB TYR A 117 2.524 11.948 -21.464 1.00 62.53 C ATOM 1866 CG TYR A 117 1.611 12.950 -22.133 1.00 70.23 C ATOM 1867 CD1 TYR A 117 1.140 14.059 -21.443 1.00 14.34 C ATOM 1868 CD2 TYR A 117 1.220 12.788 -23.457 1.00 23.31 C ATOM 1869 CE1 TYR A 117 0.304 14.977 -22.050 1.00 25.02 C ATOM 1870 CE2 TYR A 117 0.387 13.701 -24.073 1.00 13.13 C ATOM 1871 CZ TYR A 117 -0.069 14.794 -23.365 1.00 20.32 C ATOM 1872 OH TYR A 117 -0.900 15.706 -23.974 1.00 4.43 O ATOM 0 H TYR A 117 3.682 12.305 -19.305 1.00 31.02 H new ATOM 0 HA TYR A 117 0.964 11.781 -19.996 1.00 20.22 H new ATOM 0 HB2 TYR A 117 3.493 12.414 -21.286 1.00 62.53 H new ATOM 0 HB3 TYR A 117 2.693 11.112 -22.143 1.00 62.53 H new ATOM 0 HD1 TYR A 117 1.432 14.207 -20.414 1.00 14.34 H new ATOM 0 HD2 TYR A 117 1.574 11.933 -24.014 1.00 23.31 H new ATOM 0 HE1 TYR A 117 -0.055 15.833 -21.498 1.00 25.02 H new ATOM 0 HE2 TYR A 117 0.094 13.560 -25.103 1.00 13.13 H new ATOM 0 HH TYR A 117 -1.065 15.431 -24.900 1.00 4.43 H new ATOM 1882 N ALA A 118 3.038 9.261 -19.769 1.00 53.20 N ATOM 1883 CA ALA A 118 3.127 7.806 -19.751 1.00 3.44 C ATOM 1884 C ALA A 118 2.241 7.216 -18.660 1.00 33.53 C ATOM 1885 O ALA A 118 1.754 6.092 -18.784 1.00 31.33 O ATOM 1886 CB ALA A 118 4.571 7.369 -19.554 1.00 43.13 C ATOM 0 H ALA A 118 3.880 9.739 -19.448 1.00 53.20 H new ATOM 0 HA ALA A 118 2.773 7.432 -20.712 1.00 3.44 H new ATOM 0 HB1 ALA A 118 4.623 6.280 -19.542 1.00 43.13 H new ATOM 0 HB2 ALA A 118 5.182 7.753 -20.371 1.00 43.13 H new ATOM 0 HB3 ALA A 118 4.944 7.760 -18.607 1.00 43.13 H new ATOM 1892 N TRP A 119 2.036 7.979 -17.593 1.00 31.14 N ATOM 1893 CA TRP A 119 1.208 7.530 -16.479 1.00 71.41 C ATOM 1894 C TRP A 119 -0.138 7.014 -16.975 1.00 74.24 C ATOM 1895 O TRP A 119 -0.630 5.988 -16.507 1.00 32.12 O ATOM 1896 CB TRP A 119 0.995 8.670 -15.482 1.00 61.12 C ATOM 1897 CG TRP A 119 0.021 8.333 -14.394 1.00 4.34 C ATOM 1898 CD1 TRP A 119 -1.297 8.685 -14.336 1.00 20.22 C ATOM 1899 CD2 TRP A 119 0.291 7.580 -13.206 1.00 15.40 C ATOM 1900 NE1 TRP A 119 -1.864 8.196 -13.184 1.00 22.44 N ATOM 1901 CE2 TRP A 119 -0.911 7.514 -12.474 1.00 31.32 C ATOM 1902 CE3 TRP A 119 1.429 6.954 -12.691 1.00 14.22 C ATOM 1903 CZ2 TRP A 119 -1.004 6.847 -11.255 1.00 3.21 C ATOM 1904 CZ3 TRP A 119 1.335 6.293 -11.481 1.00 1.43 C ATOM 1905 CH2 TRP A 119 0.126 6.243 -10.774 1.00 42.31 C ATOM 0 H TRP A 119 2.432 8.912 -17.475 1.00 31.14 H new ATOM 0 HA TRP A 119 1.728 6.713 -15.979 1.00 71.41 H new ATOM 0 HB2 TRP A 119 1.953 8.935 -15.033 1.00 61.12 H new ATOM 0 HB3 TRP A 119 0.640 9.550 -16.018 1.00 61.12 H new ATOM 0 HD1 TRP A 119 -1.817 9.263 -15.085 1.00 20.22 H new ATOM 0 HE1 TRP A 119 -2.837 8.320 -12.903 1.00 22.44 H new ATOM 0 HE3 TRP A 119 2.365 6.986 -13.229 1.00 14.22 H new ATOM 0 HZ2 TRP A 119 -1.935 6.808 -10.709 1.00 3.21 H new ATOM 0 HZ3 TRP A 119 2.209 5.806 -11.073 1.00 1.43 H new ATOM 0 HH2 TRP A 119 0.085 5.718 -9.831 1.00 42.31 H new ATOM 1916 N GLU A 120 -0.729 7.732 -17.926 1.00 24.21 N ATOM 1917 CA GLU A 120 -2.019 7.345 -18.484 1.00 40.02 C ATOM 1918 C GLU A 120 -1.884 6.098 -19.354 1.00 2.42 C ATOM 1919 O GLU A 120 -2.821 5.309 -19.475 1.00 20.21 O ATOM 1920 CB GLU A 120 -2.608 8.493 -19.307 1.00 34.32 C ATOM 1921 CG GLU A 120 -3.400 9.491 -18.479 1.00 1.11 C ATOM 1922 CD GLU A 120 -4.776 9.766 -19.055 1.00 25.22 C ATOM 1923 OE1 GLU A 120 -5.500 8.792 -19.348 1.00 73.04 O ATOM 1924 OE2 GLU A 120 -5.127 10.954 -19.212 1.00 71.51 O ATOM 0 H GLU A 120 -0.335 8.584 -18.325 1.00 24.21 H new ATOM 0 HA GLU A 120 -2.691 7.118 -17.656 1.00 40.02 H new ATOM 0 HB2 GLU A 120 -1.799 9.017 -19.816 1.00 34.32 H new ATOM 0 HB3 GLU A 120 -3.256 8.080 -20.080 1.00 34.32 H new ATOM 0 HG2 GLU A 120 -3.505 9.112 -17.463 1.00 1.11 H new ATOM 0 HG3 GLU A 120 -2.844 10.426 -18.414 1.00 1.11 H new ATOM 1931 N ILE A 121 -0.712 5.929 -19.957 1.00 52.42 N ATOM 1932 CA ILE A 121 -0.454 4.779 -20.815 1.00 10.51 C ATOM 1933 C ILE A 121 -0.469 3.482 -20.014 1.00 62.10 C ATOM 1934 O ILE A 121 -1.027 2.475 -20.451 1.00 51.43 O ATOM 1935 CB ILE A 121 0.900 4.909 -21.537 1.00 62.50 C ATOM 1936 CG1 ILE A 121 0.958 6.216 -22.330 1.00 13.15 C ATOM 1937 CG2 ILE A 121 1.127 3.716 -22.455 1.00 11.35 C ATOM 1938 CD1 ILE A 121 -0.144 6.349 -23.357 1.00 74.21 C ATOM 0 H ILE A 121 0.074 6.573 -19.867 1.00 52.42 H new ATOM 0 HA ILE A 121 -1.251 4.753 -21.558 1.00 10.51 H new ATOM 0 HB ILE A 121 1.693 4.925 -20.789 1.00 62.50 H new ATOM 0 HG12 ILE A 121 0.901 7.055 -21.637 1.00 13.15 H new ATOM 0 HG13 ILE A 121 1.923 6.284 -22.833 1.00 13.15 H new ATOM 0 HG21 ILE A 121 2.088 3.822 -22.958 1.00 11.35 H new ATOM 0 HG22 ILE A 121 1.125 2.798 -21.867 1.00 11.35 H new ATOM 0 HG23 ILE A 121 0.331 3.672 -23.198 1.00 11.35 H new ATOM 0 HD11 ILE A 121 -0.040 7.299 -23.881 1.00 74.21 H new ATOM 0 HD12 ILE A 121 -0.075 5.530 -24.073 1.00 74.21 H new ATOM 0 HD13 ILE A 121 -1.112 6.314 -22.858 1.00 74.21 H new ATOM 1950 N LYS A 122 0.147 3.513 -18.837 1.00 62.51 N ATOM 1951 CA LYS A 122 0.203 2.340 -17.972 1.00 3.54 C ATOM 1952 C LYS A 122 -1.189 1.757 -17.755 1.00 14.34 C ATOM 1953 O LYS A 122 -1.342 0.557 -17.529 1.00 64.42 O ATOM 1954 CB LYS A 122 0.831 2.705 -16.624 1.00 54.53 C ATOM 1955 CG LYS A 122 -0.160 3.284 -15.629 1.00 40.30 C ATOM 1956 CD LYS A 122 -0.754 2.204 -14.740 1.00 45.04 C ATOM 1957 CE LYS A 122 -0.140 2.227 -13.349 1.00 2.51 C ATOM 1958 NZ LYS A 122 0.032 0.856 -12.795 1.00 74.22 N ATOM 0 H LYS A 122 0.614 4.338 -18.460 1.00 62.51 H new ATOM 0 HA LYS A 122 0.820 1.587 -18.462 1.00 3.54 H new ATOM 0 HB2 LYS A 122 1.288 1.815 -16.193 1.00 54.53 H new ATOM 0 HB3 LYS A 122 1.631 3.426 -16.789 1.00 54.53 H new ATOM 0 HG2 LYS A 122 0.338 4.032 -15.011 1.00 40.30 H new ATOM 0 HG3 LYS A 122 -0.959 3.795 -16.166 1.00 40.30 H new ATOM 0 HD2 LYS A 122 -1.832 2.345 -14.665 1.00 45.04 H new ATOM 0 HD3 LYS A 122 -0.591 1.227 -15.195 1.00 45.04 H new ATOM 0 HE2 LYS A 122 0.828 2.727 -13.388 1.00 2.51 H new ATOM 0 HE3 LYS A 122 -0.774 2.811 -12.682 1.00 2.51 H new ATOM 0 HZ1 LYS A 122 0.453 0.915 -11.846 1.00 74.22 H new ATOM 0 HZ2 LYS A 122 -0.894 0.388 -12.734 1.00 74.22 H new ATOM 0 HZ3 LYS A 122 0.658 0.306 -13.418 1.00 74.22 H new ATOM 1972 N ASP A 123 -2.202 2.614 -17.825 1.00 51.14 N ATOM 1973 CA ASP A 123 -3.583 2.183 -17.639 1.00 43.11 C ATOM 1974 C ASP A 123 -3.906 0.992 -18.535 1.00 64.44 C ATOM 1975 O ASP A 123 -4.439 -0.018 -18.075 1.00 64.31 O ATOM 1976 CB ASP A 123 -4.544 3.335 -17.936 1.00 4.52 C ATOM 1977 CG ASP A 123 -5.924 3.103 -17.353 1.00 62.01 C ATOM 1978 OD1 ASP A 123 -6.063 3.164 -16.113 1.00 41.14 O ATOM 1979 OD2 ASP A 123 -6.865 2.861 -18.137 1.00 31.21 O ATOM 0 H ASP A 123 -2.093 3.611 -18.009 1.00 51.14 H new ATOM 0 HA ASP A 123 -3.705 1.877 -16.600 1.00 43.11 H new ATOM 0 HB2 ASP A 123 -4.133 4.260 -17.532 1.00 4.52 H new ATOM 0 HB3 ASP A 123 -4.626 3.467 -19.015 1.00 4.52 H new ATOM 1984 N PHE A 124 -3.580 1.117 -19.818 1.00 13.03 N ATOM 1985 CA PHE A 124 -3.838 0.051 -20.779 1.00 45.45 C ATOM 1986 C PHE A 124 -2.918 -1.140 -20.530 1.00 65.10 C ATOM 1987 O PHE A 124 -3.342 -2.294 -20.609 1.00 4.11 O ATOM 1988 CB PHE A 124 -3.647 0.567 -22.207 1.00 41.23 C ATOM 1989 CG PHE A 124 -4.681 1.573 -22.624 1.00 74.05 C ATOM 1990 CD1 PHE A 124 -6.031 1.268 -22.553 1.00 13.43 C ATOM 1991 CD2 PHE A 124 -4.304 2.823 -23.088 1.00 13.01 C ATOM 1992 CE1 PHE A 124 -6.985 2.192 -22.937 1.00 31.23 C ATOM 1993 CE2 PHE A 124 -5.254 3.751 -23.473 1.00 22.20 C ATOM 1994 CZ PHE A 124 -6.596 3.435 -23.396 1.00 71.02 C ATOM 0 H PHE A 124 -3.137 1.945 -20.216 1.00 13.03 H new ATOM 0 HA PHE A 124 -4.870 -0.277 -20.653 1.00 45.45 H new ATOM 0 HB2 PHE A 124 -2.658 1.017 -22.293 1.00 41.23 H new ATOM 0 HB3 PHE A 124 -3.674 -0.277 -22.896 1.00 41.23 H new ATOM 0 HD1 PHE A 124 -6.341 0.298 -22.194 1.00 13.43 H new ATOM 0 HD2 PHE A 124 -3.256 3.075 -23.150 1.00 13.01 H new ATOM 0 HE1 PHE A 124 -8.034 1.942 -22.878 1.00 31.23 H new ATOM 0 HE2 PHE A 124 -4.947 4.722 -23.833 1.00 22.20 H new ATOM 0 HZ PHE A 124 -7.340 4.159 -23.694 1.00 71.02 H new ATOM 2004 N LEU A 125 -1.656 -0.853 -20.229 1.00 41.23 N ATOM 2005 CA LEU A 125 -0.674 -1.900 -19.968 1.00 50.34 C ATOM 2006 C LEU A 125 -1.122 -2.791 -18.814 1.00 42.23 C ATOM 2007 O LEU A 125 -1.302 -3.997 -18.981 1.00 62.22 O ATOM 2008 CB LEU A 125 0.688 -1.281 -19.651 1.00 44.11 C ATOM 2009 CG LEU A 125 1.623 -1.069 -20.843 1.00 1.45 C ATOM 2010 CD1 LEU A 125 2.008 -2.402 -21.464 1.00 35.43 C ATOM 2011 CD2 LEU A 125 0.970 -0.164 -21.878 1.00 24.31 C ATOM 0 H LEU A 125 -1.289 0.096 -20.160 1.00 41.23 H new ATOM 0 HA LEU A 125 -0.587 -2.514 -20.864 1.00 50.34 H new ATOM 0 HB2 LEU A 125 0.523 -0.318 -19.168 1.00 44.11 H new ATOM 0 HB3 LEU A 125 1.195 -1.918 -18.926 1.00 44.11 H new ATOM 0 HG LEU A 125 2.531 -0.583 -20.486 1.00 1.45 H new ATOM 0 HD11 LEU A 125 2.673 -2.231 -22.310 1.00 35.43 H new ATOM 0 HD12 LEU A 125 2.517 -3.016 -20.721 1.00 35.43 H new ATOM 0 HD13 LEU A 125 1.110 -2.917 -21.807 1.00 35.43 H new ATOM 0 HD21 LEU A 125 1.649 -0.024 -22.719 1.00 24.31 H new ATOM 0 HD22 LEU A 125 0.046 -0.622 -22.230 1.00 24.31 H new ATOM 0 HD23 LEU A 125 0.747 0.803 -21.427 1.00 24.31 H new ATOM 2023 N VAL A 126 -1.302 -2.188 -17.643 1.00 50.04 N ATOM 2024 CA VAL A 126 -1.732 -2.926 -16.462 1.00 13.12 C ATOM 2025 C VAL A 126 -3.134 -3.495 -16.650 1.00 31.04 C ATOM 2026 O VAL A 126 -3.475 -4.533 -16.082 1.00 10.31 O ATOM 2027 CB VAL A 126 -1.716 -2.034 -15.206 1.00 52.23 C ATOM 2028 CG1 VAL A 126 -2.666 -0.858 -15.374 1.00 51.35 C ATOM 2029 CG2 VAL A 126 -2.074 -2.847 -13.971 1.00 53.52 C ATOM 0 H VAL A 126 -1.157 -1.190 -17.487 1.00 50.04 H new ATOM 0 HA VAL A 126 -1.026 -3.745 -16.326 1.00 13.12 H new ATOM 0 HB VAL A 126 -0.708 -1.640 -15.074 1.00 52.23 H new ATOM 0 HG11 VAL A 126 -2.641 -0.239 -14.477 1.00 51.35 H new ATOM 0 HG12 VAL A 126 -2.360 -0.263 -16.234 1.00 51.35 H new ATOM 0 HG13 VAL A 126 -3.679 -1.228 -15.531 1.00 51.35 H new ATOM 0 HG21 VAL A 126 -2.058 -2.201 -13.093 1.00 53.52 H new ATOM 0 HG22 VAL A 126 -3.071 -3.271 -14.091 1.00 53.52 H new ATOM 0 HG23 VAL A 126 -1.350 -3.652 -13.843 1.00 53.52 H new ATOM 2039 N SER A 127 -3.943 -2.809 -17.451 1.00 0.14 N ATOM 2040 CA SER A 127 -5.310 -3.244 -17.711 1.00 71.22 C ATOM 2041 C SER A 127 -5.344 -4.714 -18.118 1.00 20.44 C ATOM 2042 O SER A 127 -6.290 -5.435 -17.800 1.00 51.45 O ATOM 2043 CB SER A 127 -5.941 -2.385 -18.809 1.00 63.30 C ATOM 2044 OG SER A 127 -6.895 -1.488 -18.269 1.00 54.12 O ATOM 0 H SER A 127 -3.675 -1.950 -17.931 1.00 0.14 H new ATOM 0 HA SER A 127 -5.884 -3.126 -16.792 1.00 71.22 H new ATOM 0 HB2 SER A 127 -5.164 -1.825 -19.329 1.00 63.30 H new ATOM 0 HB3 SER A 127 -6.419 -3.028 -19.548 1.00 63.30 H new ATOM 0 HG SER A 127 -6.448 -0.660 -17.997 1.00 54.12 H new ATOM 2050 N GLN A 128 -4.305 -5.151 -18.821 1.00 65.42 N ATOM 2051 CA GLN A 128 -4.215 -6.535 -19.272 1.00 33.21 C ATOM 2052 C GLN A 128 -3.979 -7.477 -18.095 1.00 52.35 C ATOM 2053 O GLN A 128 -4.581 -8.548 -18.015 1.00 4.12 O ATOM 2054 CB GLN A 128 -3.090 -6.688 -20.297 1.00 30.43 C ATOM 2055 CG GLN A 128 -3.483 -6.257 -21.700 1.00 44.54 C ATOM 2056 CD GLN A 128 -2.650 -5.096 -22.208 1.00 40.12 C ATOM 2057 OE1 GLN A 128 -1.461 -4.990 -21.905 1.00 33.02 O ATOM 2058 NE2 GLN A 128 -3.271 -4.217 -22.986 1.00 70.23 N ATOM 0 H GLN A 128 -3.513 -4.567 -19.091 1.00 65.42 H new ATOM 0 HA GLN A 128 -5.162 -6.800 -19.741 1.00 33.21 H new ATOM 0 HB2 GLN A 128 -2.232 -6.100 -19.972 1.00 30.43 H new ATOM 0 HB3 GLN A 128 -2.772 -7.730 -20.322 1.00 30.43 H new ATOM 0 HG2 GLN A 128 -3.374 -7.102 -22.380 1.00 44.54 H new ATOM 0 HG3 GLN A 128 -4.536 -5.975 -21.708 1.00 44.54 H new ATOM 0 HE21 GLN A 128 -4.258 -4.343 -23.212 1.00 70.23 H new ATOM 0 HE22 GLN A 128 -2.761 -3.415 -23.358 1.00 70.23 H new ATOM 2067 N ASP A 129 -3.100 -7.070 -17.186 1.00 74.21 N ATOM 2068 CA ASP A 129 -2.785 -7.877 -16.013 1.00 72.31 C ATOM 2069 C ASP A 129 -2.116 -9.187 -16.418 1.00 51.14 C ATOM 2070 O ASP A 129 -2.015 -10.117 -15.619 1.00 31.35 O ATOM 2071 CB ASP A 129 -4.054 -8.166 -15.210 1.00 55.20 C ATOM 2072 CG ASP A 129 -3.762 -8.467 -13.753 1.00 60.13 C ATOM 2073 OD1 ASP A 129 -2.571 -8.490 -13.380 1.00 43.32 O ATOM 2074 OD2 ASP A 129 -4.724 -8.681 -12.986 1.00 74.14 O ATOM 0 H ASP A 129 -2.593 -6.186 -17.239 1.00 74.21 H new ATOM 0 HA ASP A 129 -2.091 -7.312 -15.390 1.00 72.31 H new ATOM 0 HB2 ASP A 129 -4.724 -7.308 -15.274 1.00 55.20 H new ATOM 0 HB3 ASP A 129 -4.577 -9.012 -15.655 1.00 55.20 H new ATOM 2079 N ARG A 130 -1.662 -9.252 -17.666 1.00 22.24 N ATOM 2080 CA ARG A 130 -1.005 -10.449 -18.178 1.00 4.52 C ATOM 2081 C ARG A 130 -0.383 -10.184 -19.546 1.00 3.22 C ATOM 2082 O ARG A 130 -0.847 -10.705 -20.561 1.00 3.51 O ATOM 2083 CB ARG A 130 -2.003 -11.603 -18.275 1.00 35.14 C ATOM 2084 CG ARG A 130 -1.933 -12.569 -17.103 1.00 71.23 C ATOM 2085 CD ARG A 130 -3.295 -12.756 -16.453 1.00 22.22 C ATOM 2086 NE ARG A 130 -3.432 -14.074 -15.839 1.00 62.41 N ATOM 2087 CZ ARG A 130 -4.600 -14.613 -15.507 1.00 50.51 C ATOM 2088 NH1 ARG A 130 -5.726 -13.949 -15.729 1.00 33.12 N ATOM 2089 NH2 ARG A 130 -4.643 -15.817 -14.952 1.00 72.23 N ATOM 0 H ARG A 130 -1.737 -8.490 -18.340 1.00 22.24 H new ATOM 0 HA ARG A 130 -0.211 -10.722 -17.483 1.00 4.52 H new ATOM 0 HB2 ARG A 130 -3.012 -11.195 -18.339 1.00 35.14 H new ATOM 0 HB3 ARG A 130 -1.822 -12.152 -19.199 1.00 35.14 H new ATOM 0 HG2 ARG A 130 -1.557 -13.533 -17.446 1.00 71.23 H new ATOM 0 HG3 ARG A 130 -1.224 -12.195 -16.364 1.00 71.23 H new ATOM 0 HD2 ARG A 130 -3.444 -11.986 -15.696 1.00 22.22 H new ATOM 0 HD3 ARG A 130 -4.076 -12.622 -17.202 1.00 22.22 H new ATOM 0 HE ARG A 130 -2.584 -14.610 -15.655 1.00 62.41 H new ATOM 0 HH11 ARG A 130 -5.696 -13.023 -16.155 1.00 33.12 H new ATOM 0 HH12 ARG A 130 -6.622 -14.364 -15.473 1.00 33.12 H new ATOM 0 HH21 ARG A 130 -3.779 -16.330 -14.780 1.00 72.23 H new ATOM 0 HH22 ARG A 130 -5.540 -16.230 -14.698 1.00 72.23 H new ATOM 2103 N CYS A 131 0.668 -9.372 -19.565 1.00 3.32 N ATOM 2104 CA CYS A 131 1.353 -9.037 -20.808 1.00 42.52 C ATOM 2105 C CYS A 131 2.828 -8.742 -20.554 1.00 51.32 C ATOM 2106 O CYS A 131 3.190 -8.185 -19.518 1.00 43.24 O ATOM 2107 CB CYS A 131 0.687 -7.831 -21.473 1.00 73.20 C ATOM 2108 SG CYS A 131 0.120 -8.140 -23.162 1.00 51.51 S ATOM 0 H CYS A 131 1.064 -8.933 -18.734 1.00 3.32 H new ATOM 0 HA CYS A 131 1.282 -9.896 -21.475 1.00 42.52 H new ATOM 0 HB2 CYS A 131 -0.164 -7.519 -20.867 1.00 73.20 H new ATOM 0 HB3 CYS A 131 1.392 -7.000 -21.484 1.00 73.20 H new ATOM 0 HG CYS A 131 -0.431 -7.063 -23.639 1.00 51.51 H new ATOM 2114 N ALA A 132 3.674 -9.121 -21.506 1.00 43.43 N ATOM 2115 CA ALA A 132 5.110 -8.897 -21.386 1.00 15.51 C ATOM 2116 C ALA A 132 5.628 -8.032 -22.530 1.00 61.32 C ATOM 2117 O ALA A 132 5.400 -8.335 -23.701 1.00 22.32 O ATOM 2118 CB ALA A 132 5.850 -10.225 -21.348 1.00 72.31 C ATOM 0 H ALA A 132 3.390 -9.585 -22.369 1.00 43.43 H new ATOM 0 HA ALA A 132 5.293 -8.365 -20.452 1.00 15.51 H new ATOM 0 HB1 ALA A 132 6.921 -10.042 -21.258 1.00 72.31 H new ATOM 0 HB2 ALA A 132 5.508 -10.808 -20.492 1.00 72.31 H new ATOM 0 HB3 ALA A 132 5.652 -10.778 -22.266 1.00 72.31 H new ATOM 2124 N GLU A 133 6.326 -6.955 -22.183 1.00 74.12 N ATOM 2125 CA GLU A 133 6.875 -6.047 -23.183 1.00 13.41 C ATOM 2126 C GLU A 133 8.153 -5.387 -22.675 1.00 3.23 C ATOM 2127 O GLU A 133 8.264 -5.047 -21.496 1.00 62.45 O ATOM 2128 CB GLU A 133 5.846 -4.975 -23.550 1.00 60.02 C ATOM 2129 CG GLU A 133 5.076 -5.282 -24.824 1.00 11.34 C ATOM 2130 CD GLU A 133 5.442 -4.353 -25.965 1.00 14.53 C ATOM 2131 OE1 GLU A 133 6.584 -3.847 -25.975 1.00 31.42 O ATOM 2132 OE2 GLU A 133 4.587 -4.130 -26.847 1.00 75.20 O ATOM 0 H GLU A 133 6.524 -6.690 -21.218 1.00 74.12 H new ATOM 0 HA GLU A 133 7.116 -6.629 -24.072 1.00 13.41 H new ATOM 0 HB2 GLU A 133 5.140 -4.864 -22.727 1.00 60.02 H new ATOM 0 HB3 GLU A 133 6.355 -4.018 -23.665 1.00 60.02 H new ATOM 0 HG2 GLU A 133 5.271 -6.312 -25.122 1.00 11.34 H new ATOM 0 HG3 GLU A 133 4.007 -5.204 -24.626 1.00 11.34 H new ATOM 2139 N VAL A 134 9.117 -5.209 -23.572 1.00 45.33 N ATOM 2140 CA VAL A 134 10.389 -4.589 -23.216 1.00 75.43 C ATOM 2141 C VAL A 134 10.993 -3.853 -24.406 1.00 43.22 C ATOM 2142 O VAL A 134 11.155 -4.421 -25.487 1.00 31.45 O ATOM 2143 CB VAL A 134 11.399 -5.634 -22.706 1.00 74.42 C ATOM 2144 CG1 VAL A 134 12.747 -4.986 -22.435 1.00 2.55 C ATOM 2145 CG2 VAL A 134 10.868 -6.323 -21.458 1.00 13.32 C ATOM 0 H VAL A 134 9.042 -5.485 -24.551 1.00 45.33 H new ATOM 0 HA VAL A 134 10.182 -3.876 -22.418 1.00 75.43 H new ATOM 0 HB VAL A 134 11.536 -6.390 -23.480 1.00 74.42 H new ATOM 0 HG11 VAL A 134 13.447 -5.740 -22.075 1.00 2.55 H new ATOM 0 HG12 VAL A 134 13.130 -4.544 -23.355 1.00 2.55 H new ATOM 0 HG13 VAL A 134 12.632 -4.208 -21.680 1.00 2.55 H new ATOM 0 HG21 VAL A 134 11.594 -7.058 -21.111 1.00 13.32 H new ATOM 0 HG22 VAL A 134 10.701 -5.582 -20.677 1.00 13.32 H new ATOM 0 HG23 VAL A 134 9.928 -6.823 -21.691 1.00 13.32 H new ATOM 2155 N THR A 135 11.327 -2.582 -24.201 1.00 61.33 N ATOM 2156 CA THR A 135 11.914 -1.766 -25.257 1.00 32.42 C ATOM 2157 C THR A 135 13.175 -1.062 -24.771 1.00 25.53 C ATOM 2158 O THR A 135 13.134 -0.274 -23.825 1.00 72.02 O ATOM 2159 CB THR A 135 10.917 -0.711 -25.771 1.00 75.10 C ATOM 2160 OG1 THR A 135 9.729 -1.352 -26.251 1.00 44.23 O ATOM 2161 CG2 THR A 135 11.535 0.121 -26.884 1.00 3.20 C ATOM 0 H THR A 135 11.201 -2.096 -23.313 1.00 61.33 H new ATOM 0 HA THR A 135 12.170 -2.442 -26.073 1.00 32.42 H new ATOM 0 HB THR A 135 10.663 -0.049 -24.943 1.00 75.10 H new ATOM 0 HG1 THR A 135 9.099 -0.674 -26.574 1.00 44.23 H new ATOM 0 HG21 THR A 135 10.812 0.859 -27.231 1.00 3.20 H new ATOM 0 HG22 THR A 135 12.422 0.631 -26.508 1.00 3.20 H new ATOM 0 HG23 THR A 135 11.815 -0.530 -27.712 1.00 3.20 H new ATOM 2169 N LEU A 136 14.297 -1.351 -25.422 1.00 55.13 N ATOM 2170 CA LEU A 136 15.572 -0.744 -25.057 1.00 32.14 C ATOM 2171 C LEU A 136 16.480 -0.610 -26.275 1.00 1.34 C ATOM 2172 O LEU A 136 16.829 -1.602 -26.912 1.00 64.43 O ATOM 2173 CB LEU A 136 16.266 -1.579 -23.979 1.00 15.35 C ATOM 2174 CG LEU A 136 16.800 -0.806 -22.772 1.00 62.12 C ATOM 2175 CD1 LEU A 136 17.691 0.340 -23.225 1.00 1.33 C ATOM 2176 CD2 LEU A 136 15.652 -0.287 -21.920 1.00 13.14 C ATOM 0 H LEU A 136 14.349 -2.002 -26.205 1.00 55.13 H new ATOM 0 HA LEU A 136 15.373 0.253 -24.664 1.00 32.14 H new ATOM 0 HB2 LEU A 136 15.563 -2.331 -23.621 1.00 15.35 H new ATOM 0 HB3 LEU A 136 17.097 -2.113 -24.440 1.00 15.35 H new ATOM 0 HG LEU A 136 17.397 -1.486 -22.164 1.00 62.12 H new ATOM 0 HD11 LEU A 136 18.062 0.879 -22.353 1.00 1.33 H new ATOM 0 HD12 LEU A 136 18.533 -0.056 -23.792 1.00 1.33 H new ATOM 0 HD13 LEU A 136 17.117 1.020 -23.855 1.00 1.33 H new ATOM 0 HD21 LEU A 136 16.051 0.260 -21.066 1.00 13.14 H new ATOM 0 HD22 LEU A 136 15.027 0.377 -22.517 1.00 13.14 H new ATOM 0 HD23 LEU A 136 15.054 -1.126 -21.566 1.00 13.14 H new